A0A096NBD6_PAPAN Loading...

Acyl-CoA-binding domain-containing protein 6

Binds long-chain acyl-coenzyme A molecules with a strong preference for unsaturated C18:1-CoA, lower affinity for unsaturated C20:4-CoA, and very weak affinity for saturated C16:0-CoA. Does not bind fatty acids. Plays a role in protein N-myristoylation.

AlphaFold DB (A0A2K5KU78), UniProt , Accession A0A096NBD6, Species PAPAN (Papio anubis, Olive baboon), Gene ACBD6, Length 282 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	38.8	Very low	248 Å²	248	134 Å²	134	100%	1.222	86%	0.857	S	S	*	*				0	134.8	0	-70.5	-166.3	-158.9	0	0	108
2	A	36.9	Very low	38.9	Very low	91 Å²	91	134.8 Å²	134.8	75%	0.752	86%	0.859	S	S	*	*			trans	-58.3	155	177.8	0	0	0	0	0	112.6
3	S	38.3	Very low	38.9	Very low	115 Å²	115	130.7 Å²	130.7	80%	0.804	86%	0.857	S	S	*	*				-178.8	127.2	107.4	-74.1	0	0	0	0	111.3
4	S	41.7	Very low	38.7	Very low	107 Å²	107	132.3 Å²	132.3	75%	0.748	85%	0.854	S	S	*	*			trans	-57.5	166.4	162.6	-37.3	0	0	0	0	111.9
5	F	36.9	Very low	39.2	Very low	205 Å²	205	131.2 Å²	131.2	90%	0.899	85%	0.851	S	S	*	*				-177.6	124.1	126.6	-104.1	-76	0	0	0	111.1
6	L	38.9	Very low	38.9	Very low	158 Å²	158	128 Å²	128	83%	0.827	85%	0.85	S	S	*	*			trans	-71.5	170.6	157.5	-71.6	164.9	0	0	0	109.7
7	P	53.3	Low	38.6	Very low	128 Å²	128	124.6 Å²	124.6	83%	0.831	84%	0.843	S	S	*	*				-141.4	166.9	108.6	33.5	-17.1	0	0	0	115.9
8	A	36.1	Very low	38.5	Very low	105 Å²	105	128.2 Å²	128.2	87%	0.868	85%	0.845	S	S	*	*			trans	-84.8	173.7	-174.2	0	0	0	0	0	114.6
9	G	33.8	Very low	38.8	Very low	75 Å²	75	130.5 Å²	130.5	77%	0.773	85%	0.848	S	S	*	*			trans	147	95.4	146.8	0	0	0	0	0	117.6
10	A	34.8	Very low	39	Very low	101 Å²	101	130.1 Å²	130.1	84%	0.835	85%	0.848	S	S	*	*			trans	22.9	139.2	141.1	0	0	0	0	0	122.1
11	T	39.8	Very low	39.4	Very low	141 Å²	141	129.5 Å²	129.5	87%	0.865	85%	0.847	S	S	*	*				-157.6	143.8	111	68.1	0	0	0	0	112.2
12	T	40	Very low	39.4	Very low	144 Å²	144	121.3 Å²	121.3	88%	0.883	83%	0.826	S	S	*	*			trans	-69.7	158.4	171.7	48.5	0	0	0	0	114.2
13	G	38.1	Very low	39.7	Very low	81 Å²	81	125 Å²	125	84%	0.835	83%	0.833	S	S	*	*			trans	179.2	84.9	166.4	0	0	0	0	0	113.8
14	D	36.8	Very low	39.9	Very low	153 Å²	153	126.9 Å²	126.9	82%	0.818	83%	0.834	S	S	*	*			trans	-78.6	142.6	167.9	173.1	35.9	0	0	0	110.7
15	S	45.3	Very low	40.3	Very low	116 Å²	116	127.5 Å²	127.5	81%	0.811	84%	0.838	S	S	*	*			trans	-179.3	128.9	142.7	-79.8	0	0	0	0	111.4
16	G	35.1	Very low	40.3	Very low	80 Å²	80	120.6 Å²	120.6	83%	0.825	83%	0.825	S	S	*	*			trans	-79.6	-170.2	-171.1	0	0	0	0	0	117.2
17	G	33.8	Very low	40.4	Very low	71 Å²	71	122.2 Å²	122.2	73%	0.732	83%	0.829	S	S	*	*			trans	148.3	85.7	161.8	0	0	0	0	0	117.5
18	E	36.8	Very low	39.7	Very low	188 Å²	188	121.4 Å²	121.4	88%	0.879	82%	0.821	S	S	*	*			trans	65.6	114.6	135.9	-46.9	-161.1	116.4	0	0	123
19	L	43.8	Very low	39.9	Very low	172 Å²	172	125.1 Å²	125.1	90%	0.901	82%	0.821	S	S	*	*			trans	15.3	120.9	135	-53.2	170.6	0	0	0	119.3
20	S	42.6	Very low	40	Very low	122 Å²	122	129.7 Å²	129.7	85%	0.853	82%	0.819	S	S	*	*			trans	-153.5	125.5	139.9	-165.1	0	0	0	0	111.5
21	S	47	Very low	40.3	Very low	119 Å²	119	130.3 Å²	130.3	83%	0.832	82%	0.815	S	S	*	*			trans	-70.6	140.7	175.2	47.5	0	0	0	0	112.3
22	G	38	Very low	40.2	Very low	75 Å²	75	131.3 Å²	131.3	77%	0.773	81%	0.81	S	S	*	*			trans	-168.9	90	167.1	0	0	0	0	0	110.5
23	D	42.2	Very low	40.5	Very low	169 Å²	169	127.5 Å²	127.5	90%	0.904	79%	0.789	S	S	*	*			trans	-63.6	124.5	159.2	-67	-48.8	0	0	0	108.2
24	D	43.2	Very low	41.1	Very low	155 Å²	155	128 Å²	128	83%	0.829	78%	0.777	S	S	*	*			trans	-138.5	110.9	156	-170	37.7	0	0	0	108.4	G26	D24-G26 PolarHBondContact O-N 2.93Å
25	S	50.1	Low	41.7	Very low	119 Å²	119	128.4 Å²	128.4	83%	0.832	77%	0.774	S	S	*	*			trans	-79.5	94.4	178.1	-63.9	0	0	0	0	108.5
26	G	35.8	Very low	41.9	Very low	61 Å²	61	128.8 Å²	128.8	63%	0.629	77%	0.766	S	S	*	*			trans	-95.5	92.4	163.7	0	0	0	0	0	109.7	D24 V28	D24-G26 PolarHBondContact O-N 2.93Å; G26-V28 PolarHBondContact O-N 3.33Å
27	E	41.8	Very low	42.5	Very low	192 Å²	192	130.7 Å²	130.7	90%	0.897	75%	0.753	S	S	*	*			trans	-62.1	100.7	167.6	-144.9	174.5	-173.4	0	0	108	E29	E27-E29 PolarHBondContact O-N 3.44Å
28	V	39.2	Very low	43.6	Very low	110 Å²	110	134.5 Å²	134.5	67%	0.667	75%	0.752	S	S	*	*			trans	-80.5	93.1	171.7	-75.5	0	0	0	0	108	G26 F30	G26-V28 PolarHBondContact O-N 3.33Å; V28-F30 HydrophobicContact CG2-CD2 4.46Å; V28-F30 HydrophobicContact CG2-CE2 3.94Å; V28-F30 PolarHBondContact O-N 2.95Å
29	E	38.9	Very low	44.7	Very low	184 Å²	184	128.5 Å²	128.5	86%	0.86	73%	0.731	S	S	*	*			trans	-60	107.2	160.1	-82.5	-158.8	151	0	0	108.1	E27	E27-E29 PolarHBondContact O-N 3.44Å
30	F	37.8	Very low	45.4	Very low	171 Å²	171	123.4 Å²	123.4	75%	0.75	71%	0.71	S	S	*	*			trans	-69.1	136.1	166	-79.4	-89.8	0	0	0	108.6	V28 H32	V28-F30 HydrophobicContact CG2-CD2 4.46Å; V28-F30 HydrophobicContact CG2-CE2 3.94Å; V28-F30 PolarHBondContact O-N 2.95Å; F30-H32 PolarHBondContact O-N 3.26Å; F30-H32 VanDerWaalsContact O-N 3.15Å
31	P	39.6	Very low	47.3	Very low	114 Å²	114	120.8 Å²	120.8	74%	0.74	69%	0.69	S	S	*	*			trans	-63.6	119.9	174.9	-12.2	25.6	0	0	0	109.3	S33	P31-S33 PolarHBondContact O-N 3.44Å; P31-S33 VanDerWaalsContact O-N 3.08Å
32	H	38.9	Very low	49.1	Very low	162 Å²	162	116.3 Å²	116.3	75%	0.75	66%	0.657	S	S	*	*			trans	-63	106.7	167.8	-85	-92.8	0	0	0	109	F30 P34 E37	F30-H32 PolarHBondContact O-N 3.26Å; F30-H32 VanDerWaalsContact O-N 3.15Å; H32-P34 WeakPolarHBondContact O-CD 3.36Å; H32-E37 IonicContact ND1-OE1 3.77Å
33	S	45.7	Very low	51.3	Low	64 Å²	64	114.6 Å²	114.6	45%	0.448	64%	0.635	S	S	.	*			trans	-70.7	116.9	174.6	-59	0	0	0	0	109.9	P31 E35 I36	P31-S33 PolarHBondContact O-N 3.44Å; P31-S33 VanDerWaalsContact O-N 3.08Å; S33-E35 PolarHBondContact O-N 3.04Å; S33-E35 VanDerWaalsContact O-N 3.1Å; S33-I36 PolarHBondContact O-N 3.3Å; S33-I36 VanDerWaalsContact O-N 3.16Å
34	P	51.3	Low	53.4	Low	90 Å²	90	112 Å²	112	58%	0.584	62%	0.618	S	S	*	*	H	α-helix	trans	-62.3	-21.1	-175.2	22.2	-32.3	0	0	0	114.1	H32 I36 E37 E38	H32-P34 WeakPolarHBondContact O-CD 3.36Å; P34-I36 VanDerWaalsContact C-N 3.27Å; P34-I36 PolarHBondContact O-N 3.2Å; P34-E37 PolarHBondContact O-N 3.29Å; P34-E38 PolarHBondContact O-N 3.27Å
35	E	48.1	Very low	55.4	Low	163 Å²	163	106.9 Å²	106.9	76%	0.762	59%	0.59	S	S	*	*	H	α-helix	trans	-65.9	-26.2	177.9	-62.7	-177.6	170.4	0	0	113.4	S33 S39	S33-E35 PolarHBondContact O-N 3.04Å; S33-E35 VanDerWaalsContact O-N 3.1Å; E35-S39 WeakPolarHBondContact O-CB 3.28Å; E35-S39 PolarHBondContact O-N 2.99Å
36	I	49.5	Very low	57.2	Low	123 Å²	123	101.3 Å²	101.3	63%	0.631	55%	0.551	S	S	*	*	H	α-helix	trans	-78.7	-35.9	179.5	-58.8	177.2	0	0	0	110.4	S33 P34 S40	S33-I36 PolarHBondContact O-N 3.3Å; S33-I36 VanDerWaalsContact O-N 3.16Å; P34-I36 VanDerWaalsContact C-N 3.27Å; P34-I36 PolarHBondContact O-N 3.2Å; I36-S40 WeakPolarHBondContact O-CB 3.3Å; I36-S40 PolarHBondContact O-N 2.77Å; I36-S40 VanDerWaalsContact O-N 3.08Å
37	E	49.3	Very low	59.5	Low	120 Å²	120	102 Å²	102	56%	0.561	54%	0.538	S	S	*	.	H	α-helix	trans	-72.2	-40.5	179.1	-69.4	-174.4	176	0	0	112.3	H32 P34 S39 S40 C41	H32-E37 IonicContact ND1-OE1 3.77Å; P34-E37 PolarHBondContact O-N 3.29Å; E37-S39 PolarHBondContact O-N 2.97Å; E37-S40 PolarHBondContact O-N 3.38Å; E37-C41 VanDerWaalsContact O-CB 3.32Å; E37-C41 WeakPolarHBondContact O-CB 3.47Å; E37-C41 PolarHBondContact O-N 2.97Å
38	E	56.3	Low	61.6	Low	152 Å²	152	97.3 Å²	97.3	71%	0.71	51%	0.514	S	S	*	.	H	α-helix	trans	-64.6	-39.4	175.5	-73.4	-170.5	169.7	0	0	112.3	P34 C41 L42	P34-E38 PolarHBondContact O-N 3.27Å; E38-C41 PolarHBondContact O-N 3.48Å; E38-L42 VanDerWaalsContact O-CB 3.32Å; E38-L42 WeakPolarHBondContact O-CB 3.38Å; E38-L42 PolarHBondContact O-N 2.93Å
39	S	58.7	Low	63.8	Low	62 Å²	62	92 Å²	92	43%	0.434	48%	0.483	S	S	.	.	H	α-helix	trans	-65.1	-43	176	-176.2	0	0	0	0	112.1	E35 E37 L42 A43	E35-S39 WeakPolarHBondContact O-CB 3.28Å; E35-S39 PolarHBondContact O-N 2.99Å; E37-S39 PolarHBondContact O-N 2.97Å; S39-L42 PolarHBondContact O-N 3.33Å; S39-A43 PolarHBondContact O-N 2.66Å; S39-A43 VanDerWaalsContact O-N 3.1Å
40	S	60.3	Low	65.8	Low	65 Å²	65	83.8 Å²	83.8	46%	0.455	45%	0.446	S	S	.	.	H	α-helix	trans	-64.1	-43.7	176	-169.3	0	0	0	0	112	I36 E37 A43 E44	I36-S40 WeakPolarHBondContact O-CB 3.3Å; I36-S40 PolarHBondContact O-N 2.77Å; I36-S40 VanDerWaalsContact O-N 3.08Å; E37-S40 PolarHBondContact O-N 3.38Å; S40-A43 PolarHBondContact O-N 2.91Å; S40-E44 PolarHBondContact O-N 2.74Å
41	C	82.1	Confident	67.8	Low	67 Å²	67	78.8 Å²	78.8	45%	0.453	44%	0.436	S	S	.	.	H	α-helix	trans	-65	-40.1	178.2	-177.2	0	0	0	0	112.2	E37 E38 E44 L45	E37-C41 VanDerWaalsContact O-CB 3.32Å; E37-C41 WeakPolarHBondContact O-CB 3.47Å; E37-C41 PolarHBondContact O-N 2.97Å; E38-C41 PolarHBondContact O-N 3.48Å; C41-E44 PolarHBondContact O-N 3.37Å; C41-L45 WeakPolarHBondContact O-CG 3.38Å; C41-L45 PolarHBondContact O-N 3.35Å
42	L	84.7	Confident	70	Confident	25 Å²	25	75 Å²	75	13%	0.131	41%	0.408	C	S	.	.	H	α-helix	trans	-65.5	-41.8	178	-177.9	63.3	0	0	0	112.1	E38 S39 L45 F46 M111 Q112 I115	E38-L42 VanDerWaalsContact O-CB 3.32Å; E38-L42 WeakPolarHBondContact O-CB 3.38Å; E38-L42 PolarHBondContact O-N 2.93Å; S39-L42 PolarHBondContact O-N 3.33Å; L42-L45 PolarHBondContact O-N 3.49Å; L42-F46 WeakPolarHBondContact O-CB 3.43Å; L42-F46 PolarHBondContact O-N 3.22Å; L42-M111 HydrophobicContact CD1-CB 4.18Å; L42-M111 HydrophobicContact CD2-CB 4.01Å; L42-M111 HydrophobicContact CD2-SD 4.44Å; L42-M111 HydrophobicContact CG-CB 3.86Å; L42-M111 HydrophobicContact CG-SD 4.13Å; L42-Q112 HydrophobicContact CD1-CG 3.84Å; L42-Q112 HydrophobicContact CD2-CG 4.06Å; L42-I115 HydrophobicContact CD1-CD1 3.67Å
43	A	84.2	Confident	71.9	Confident	38 Å²	38	67.7 Å²	67.7	31%	0.314	38%	0.375	S	S	.	.	H	α-helix	trans	-61.8	-44	176.5	0	0	0	0	0	111.7	S39 S40 L45 F46 E47 M111	S39-A43 PolarHBondContact O-N 2.66Å; S39-A43 VanDerWaalsContact O-N 3.1Å; S40-A43 PolarHBondContact O-N 2.91Å; A43-L45 PolarHBondContact O-N 3.1Å; A43-F46 WeakPolarHBondContact O-CB 3.31Å; A43-F46 PolarHBondContact O-N 2.84Å; A43-E47 WeakPolarHBondContact O-CG 3.2Å; A43-E47 PolarHBondContact O-N 3.45Å; A43-M111 HydrophobicContact CB-SD 4.23Å
44	E	85.5	Confident	73.1	Confident	115 Å²	115	68.9 Å²	68.9	54%	0.537	37%	0.373	S	S	.	.	H	α-helix	trans	-62.4	-42.5	175.9	-73.3	-178	-169.1	0	0	112.9	S40 C41 F46 E47 K48	S40-E44 PolarHBondContact O-N 2.74Å; C41-E44 PolarHBondContact O-N 3.37Å; E44-F46 VanDerWaalsContact C-N 3.29Å; E44-F46 PolarHBondContact O-N 2.97Å; E44-E47 PolarHBondContact O-N 3.42Å; E44-K48 WeakPolarHBondContact O-CG 3.48Å; E44-K48 PolarHBondContact O-N 3.1Å; E44-K48 VanDerWaalsContact O-N 3.1Å
45	L	86.1	Confident	74.1	Confident	48 Å²	48	67.5 Å²	67.5	25%	0.251	38%	0.376	S	S	.	.	H	α-helix	trans	-63.9	-37.6	176.3	-74.7	169.6	0	0	0	111.9	C41 L42 A43 K48 A49 I115 P127	C41-L45 WeakPolarHBondContact O-CG 3.38Å; C41-L45 PolarHBondContact O-N 3.35Å; L42-L45 PolarHBondContact O-N 3.49Å; A43-L45 PolarHBondContact O-N 3.1Å; L45-K48 PolarHBondContact O-N 3.45Å; L45-A49 WeakPolarHBondContact O-CB 3.23Å; L45-A49 PolarHBondContact O-N 3.36Å; L45-I115 HydrophobicContact CB-CD1 3.85Å; L45-P127 HydrophobicContact CD2-CB 3.76Å; L45-P127 HydrophobicContact CD2-CG 3.5Å; L45-P127 VanDerWaalsContact CD2-CG 3.5Å
46	F	87.3	Confident	75.5	Confident	1 Å²	1	60.3 Å²	60.3	0%	0.004	34%	0.342	C	S	.	.	H	α-helix	trans	-63.9	-45.5	175.6	167.6	-96.6	0	0	0	111.7	L42 A43 E44 K48 A49 A50 Y72 V75 M111 Y114 I115	L42-F46 WeakPolarHBondContact O-CB 3.43Å; L42-F46 PolarHBondContact O-N 3.22Å; A43-F46 WeakPolarHBondContact O-CB 3.31Å; A43-F46 PolarHBondContact O-N 2.84Å; E44-F46 VanDerWaalsContact C-N 3.29Å; E44-F46 PolarHBondContact O-N 2.97Å; F46-K48 VanDerWaalsContact C-N 3.32Å; F46-K48 PolarHBondContact O-N 3.17Å; F46-A49 WeakPolarHBondContact O-CB 3.27Å; F46-A49 PolarHBondContact O-N 3.08Å; F46-A49 VanDerWaalsContact O-N 3.15Å; F46-A50 WeakPolarHBondContact O-CB 3.47Å; F46-A50 PolarHBondContact O-N 3.15Å; F46-Y72 AromaticContact CE1-CD2 3.96Å; F46-Y72 HydrophobicContact CE1-CD2 3.96Å; F46-Y72 HydrophobicContact CE1-CE2 4.01Å; F46-Y72 HydrophobicContact CE2-CD2 4.12Å; F46-Y72 AromaticContact CZ-CD2 3.31Å; F46-Y72 HydrophobicContact CZ-CD2 3.31Å; F46-Y72 AromaticContact CZ-CE2 3.84Å; F46-Y72 HydrophobicContact CZ-CE2 3.84Å; F46-Y72 HydrophobicContact CZ-CG 4.07Å; F46-V75 HydrophobicContact CD1-CG1 4.13Å; F46-V75 HydrophobicContact CE1-CB 4.18Å; F46-V75 HydrophobicContact CE1-CG1 3.7Å; F46-V75 HydrophobicContact CE2-CB 4.29Å; F46-V75 HydrophobicContact CE2-CG1 4.44Å; F46-V75 HydrophobicContact CE2-CG2 4.01Å; F46-V75 HydrophobicContact CZ-CB 3.81Å; F46-V75 HydrophobicContact CZ-CG1 3.85Å; F46-V75 HydrophobicContact CZ-CG2 4.05Å; F46-M111 HydrophobicContact CB-CB 4.16Å; F46-M111 HydrophobicContact CB-CG 3.9Å; F46-M111 HydrophobicContact CB-SD 4.15Å; F46-M111 HydrophobicContact CD1-CG 4.36Å; F46-M111 HydrophobicContact CD2-CB 4.2Å; F46-M111 HydrophobicContact CD2-CG 3.88Å; F46-M111 HydrophobicContact CE2-CG 4.5Å; F46-M111 HydrophobicContact CG-CB 4.34Å; F46-M111 HydrophobicContact CG-CG 3.78Å; F46-M111 HydrophobicContact CG-SD 4.39Å; F46-Y114 AromaticContact CD2-CD1 3.81Å; F46-Y114 HydrophobicContact CD2-CD1 3.81Å; F46-Y114 AromaticContact CD2-CG 3.91Å; F46-Y114 HydrophobicContact CD2-CG 3.91Å; F46-Y114 AromaticContact CE2-CD1 3.85Å; F46-Y114 HydrophobicContact CE2-CD1 3.85Å; F46-Y114 AromaticContact CE2-CD2 3.97Å; F46-Y114 HydrophobicContact CE2-CD2 3.97Å; F46-Y114 HydrophobicContact CE2-CE1 4.37Å; F46-Y114 HydrophobicContact CE2-CE2 4.47Å; F46-Y114 AromaticContact CE2-CG 3.63Å; F46-Y114 HydrophobicContact CE2-CG 3.63Å; F46-I115 HydrophobicContact CB-CD1 4.2Å; F46-I115 HydrophobicContact CB-CG1 4.46Å
47	E	85.3	Confident	76.5	Confident	75 Å²	75	57.3 Å²	57.3	35%	0.35	33%	0.327	S	S	.	.	H	α-helix	trans	-60.9	-41.5	176.3	-66.9	-54.8	150.7	0	0	112.1	A43 E44 A49 A50 A51 K76	A43-E47 WeakPolarHBondContact O-CG 3.2Å; A43-E47 PolarHBondContact O-N 3.45Å; E44-E47 PolarHBondContact O-N 3.42Å; E47-A49 VanDerWaalsContact C-N 3.34Å; E47-A49 PolarHBondContact O-N 2.99Å; E47-A50 PolarHBondContact O-N 3.15Å; E47-A51 PolarHBondContact O-N 3Å; E47-K76 WeakPolarHBondContact OE1-CE 3.39Å; E47-K76 IonicContact OE1-NZ 2.54Å; E47-K76 PolarHBondContact OE1-NZ 2.78Å; E47-K76 IonicContact OE2-NZ 3.73Å
48	K	85.6	Confident	77.5	Confident	94 Å²	94	59.6 Å²	59.6	41%	0.409	34%	0.338	S	S	.	.	H	α-helix	trans	-63.2	-40.6	175.3	-70.4	175.5	178	179.5	0	111.8	E44 L45 F46 A50 A51 H52 W125 P127	E44-K48 WeakPolarHBondContact O-CG 3.48Å; E44-K48 PolarHBondContact O-N 3.1Å; E44-K48 VanDerWaalsContact O-N 3.1Å; L45-K48 PolarHBondContact O-N 3.45Å; F46-K48 VanDerWaalsContact C-N 3.32Å; F46-K48 PolarHBondContact O-N 3.17Å; K48-A50 VanDerWaalsContact C-N 3.33Å; K48-A51 PolarHBondContact O-N 3.17Å; K48-H52 PolarHBondContact O-N 3.01Å; K48-W125 HydrophobicContact CB-CH2 4.38Å; K48-W125 HydrophobicContact CB-CZ2 4Å; K48-W125 WeakPolarHBondContact O-CZ2 3.46Å; K48-P127 HydrophobicContact CB-CB 4.28Å; K48-P127 HydrophobicContact CD-CB 3.91Å; K48-P127 WeakPolarHBondContact CD-O 3.48Å; K48-P127 PolarHBondContact NZ-O 3.48Å
49	A	84.1	Confident	78.4	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-40.6	175.8	0	0	0	0	0	111.3	L45 F46 E47 H52 L53 Y114 I115 V118 W125	L45-A49 WeakPolarHBondContact O-CB 3.23Å; L45-A49 PolarHBondContact O-N 3.36Å; F46-A49 WeakPolarHBondContact O-CB 3.27Å; F46-A49 PolarHBondContact O-N 3.08Å; F46-A49 VanDerWaalsContact O-N 3.15Å; E47-A49 VanDerWaalsContact C-N 3.34Å; E47-A49 PolarHBondContact O-N 2.99Å; A49-H52 PolarHBondContact O-N 2.99Å; A49-L53 PolarHBondContact O-N 2.74Å; A49-L53 VanDerWaalsContact O-N 3.1Å; A49-Y114 HydrophobicContact CB-CD1 3.95Å; A49-Y114 HydrophobicContact CB-CE1 3.84Å; A49-I115 HydrophobicContact CB-CG1 4.06Å; A49-V118 HydrophobicContact CB-CB 4.27Å; A49-V118 HydrophobicContact CB-CG1 4.26Å; A49-V118 HydrophobicContact CB-CG2 4.16Å; A49-W125 HydrophobicContact CB-CH2 3.48Å; A49-W125 VanDerWaalsContact CB-CH2 3.48Å; A49-W125 HydrophobicContact CB-CZ2 4.33Å; A49-W125 HydrophobicContact CB-CZ3 3.9Å
50	A	81.8	Confident	79.1	Confident	11 Å²	11	55 Å²	55	9%	0.091	32%	0.318	C	S	.	.	H	α-helix	trans	-65.7	-38.9	178.8	0	0	0	0	0	112.3	F46 E47 K48 Y72 Y114	F46-A50 WeakPolarHBondContact O-CB 3.47Å; F46-A50 PolarHBondContact O-N 3.15Å; E47-A50 PolarHBondContact O-N 3.15Å; K48-A50 VanDerWaalsContact C-N 3.33Å; A50-Y72 HydrophobicContact CB-CD2 4.11Å; A50-Y72 HydrophobicContact CB-CE2 3.92Å; A50-Y114 WeakPolarHBondContact CA-OH 3.25Å; A50-Y114 HydrophobicContact CB-CE1 4.18Å
51	A	80.3	Confident	79.9	Confident	66 Å²	66	54.4 Å²	54.4	55%	0.545	31%	0.314	S	S	.	.	H	α-helix	trans	-64.6	-40.3	172.4	0	0	0	0	0	112.2	E47 K48 L53 Q54	E47-A51 PolarHBondContact O-N 3Å; K48-A51 PolarHBondContact O-N 3.17Å; A51-L53 VanDerWaalsContact C-N 3.32Å; A51-L53 PolarHBondContact O-N 3.33Å; A51-Q54 PolarHBondContact O-N 3.44Å
52	H	84.8	Confident	79.2	Confident	34 Å²	34	55.8 Å²	55.8	16%	0.157	31%	0.31	C	S	.	.	H	α-helix	trans	-67.2	-30	-179.8	-167.8	56.5	0	0	0	113.5	K48 A49 Q54 G55 V118 D122 W125	K48-H52 PolarHBondContact O-N 3.01Å; A49-H52 PolarHBondContact O-N 2.99Å; H52-Q54 PolarHBondContact O-N 3.43Å; H52-G55 PolarHBondContact O-N 3.14Å; H52-V118 HydrophobicContact CB-CG1 4.49Å; H52-D122 IonicContact CD2-OD2 3.93Å; H52-D122 IonicContact CE1-OD2 3.8Å; H52-D122 PolarHBondContact CE1-OD2 3.48Å; H52-D122 IonicContact NE2-OD2 2.89Å; H52-D122 PolarHBondContact NE2-OD2 3.5Å; H52-W125 HydrophobicContact CB-CD2 4.42Å; H52-W125 HydrophobicContact CB-CZ2 4.08Å; H52-W125 AromaticContact CD2-CD1 3.35Å; H52-W125 AromaticContact CD2-CD2 3.77Å; H52-W125 AromaticContact CD2-CE2 3.96Å; H52-W125 AromaticContact CD2-CG 3.41Å; H52-W125 VanDerWaalsContact CD2-CG 3.41Å; H52-W125 AromaticContact CD2-NE1 3.67Å; H52-W125 AromaticContact CE1-CD1 3.45Å; H52-W125 VanDerWaalsContact CE1-CD1 3.45Å; H52-W125 AromaticContact CG-CD1 3.42Å; H52-W125 VanDerWaalsContact CG-CD1 3.42Å; H52-W125 AromaticContact CG-CE2 3.82Å; H52-W125 AromaticContact CG-CG 3.91Å; H52-W125 AromaticContact CG-NE1 3.33Å; H52-W125 VanDerWaalsContact CG-NE1 3.33Å; H52-W125 AromaticContact ND1-CD1 3.48Å; H52-W125 AromaticContact ND1-NE1 3.6Å; H52-W125 AromaticContact NE2-CD1 3.37Å; H52-W125 AromaticContact NE2-CG 3.54Å
53	L	79.1	Confident	78.7	Confident	9 Å²	9	62.1 Å²	62.1	5%	0.047	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-55.1	-27.6	-179.5	-176.1	57.9	0	0	0	112.9	A49 A51 G55 L56 I57 L65 L68 Y114 L121 I146	A49-L53 PolarHBondContact O-N 2.74Å; A49-L53 VanDerWaalsContact O-N 3.1Å; A51-L53 VanDerWaalsContact C-N 3.32Å; A51-L53 PolarHBondContact O-N 3.33Å; L53-G55 PolarHBondContact O-N 2.88Å; L53-L56 HydrophobicContact CD1-CB 4.21Å; L53-L56 PolarHBondContact O-N 3.35Å; L53-I57 PolarHBondContact O-N 2.97Å; L53-L65 HydrophobicContact CD1-CD2 4.12Å; L53-L68 HydrophobicContact CD1-CD1 3.49Å; L53-L68 VanDerWaalsContact CD1-CD1 3.49Å; L53-L68 HydrophobicContact CD2-CB 4.12Å; L53-L68 HydrophobicContact CD2-CD1 3.93Å; L53-L68 HydrophobicContact CG-CD1 4.39Å; L53-Y114 WeakPolarHBondContact CD2-OH 3.28Å; L53-L121 HydrophobicContact CD1-CD1 4.39Å; L53-I146 HydrophobicContact CD2-CD1 4.05Å
54	Q	70.1	Confident	78.5	Confident	89 Å²	89	63.8 Å²	63.8	42%	0.416	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-55.7	-36.1	174.4	170.2	154.5	22.9	0	0	113.4	A51 H52 L56 V145	A51-Q54 PolarHBondContact O-N 3.44Å; H52-Q54 PolarHBondContact O-N 3.43Å; Q54-L56 VanDerWaalsContact C-N 3.28Å; Q54-L56 PolarHBondContact O-N 3.27Å; Q54-V145 HydrophobicContact CB-CB 3.97Å; Q54-V145 HydrophobicContact CB-CG1 4.25Å; Q54-V145 HydrophobicContact CB-CG2 3.97Å; Q54-V145 HydrophobicContact CG-CB 4.08Å; Q54-V145 HydrophobicContact CG-CG2 3.51Å; Q54-V145 VanDerWaalsContact NE2-CG2 3.3Å
55	G	73.8	Confident	78.1	Confident	61 Å²	61	60.7 Å²	60.7	63%	0.629	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-77.4	-12	176	0	0	0	0	0	114.2	H52 L53	H52-G55 PolarHBondContact O-N 3.14Å; L53-G55 PolarHBondContact O-N 2.88Å
56	L	75.8	Confident	77.5	Confident	12 Å²	12	59.8 Å²	59.8	6%	0.063	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-3.6	-169.5	-56.8	178.1	0	0	0	113.9	L53 Q54 Q58 V59 A60 V118 L121 D122	L53-L56 HydrophobicContact CD1-CB 4.21Å; L53-L56 PolarHBondContact O-N 3.35Å; Q54-L56 VanDerWaalsContact C-N 3.28Å; Q54-L56 PolarHBondContact O-N 3.27Å; L56-Q58 VanDerWaalsContact C-N 3.26Å; L56-Q58 PolarHBondContact O-N 3.25Å; L56-V59 PolarHBondContact O-N 2.89Å; L56-A60 WeakPolarHBondContact O-CB 3.28Å; L56-A60 PolarHBondContact O-N 3.39Å; L56-V118 HydrophobicContact CD1-CG1 4.06Å; L56-L121 HydrophobicContact CD1-CB 3.88Å; L56-L121 HydrophobicContact CD1-CD1 4.49Å; L56-D122 HydrophobicContact CD1-CB 4.12Å; L56-D122 HydrophobicContact CD2-CB 3.79Å
57	I	71.5	Confident	77.3	Confident	60 Å²	60	62.8 Å²	62.8	31%	0.308	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-44.3	-177.1	-53	168.9	0	0	0	111.7	L53 V59 L65 V145	L53-I57 PolarHBondContact O-N 2.97Å; I57-V59 PolarHBondContact O-N 2.96Å; I57-L65 HydrophobicContact CG2-CD1 4.27Å; I57-V145 HydrophobicContact CD1-CB 4.2Å; I57-V145 HydrophobicContact CD1-CG1 3.27Å; I57-V145 HydrophobicContact CD1-CG2 3.86Å; I57-V145 HydrophobicContact CG1-CG1 3.9Å
58	Q	69.3	Low	77.1	Confident	168 Å²	168	59.2 Å²	59.2	79%	0.785	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-14.8	-176.6	-62.2	-63.6	-32.4	0	0	113.2	L56	L56-Q58 VanDerWaalsContact C-N 3.26Å; L56-Q58 PolarHBondContact O-N 3.25Å
59	V	75.4	Confident	76.8	Confident	106 Å²	106	55.5 Å²	55.5	64%	0.642	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-29.7	-176.8	-175.4	0	0	0	0	111.3	L56 I57	L56-V59 PolarHBondContact O-N 2.89Å; I57-V59 PolarHBondContact O-N 2.96Å
60	A	73.5	Confident	76.5	Confident	12 Å²	12	55.5 Å²	55.5	10%	0.099	30%	0.301	C	S	.	.	S	Bend	trans	-77.3	140.7	-179.6	0	0	0	0	0	111.6	L56 Q64 L65 L121	L56-A60 WeakPolarHBondContact O-CB 3.28Å; L56-A60 PolarHBondContact O-N 3.39Å; A60-Q64 HydrophobicContact CB-CB 4.44Å; A60-L65 HydrophobicContact CB-CD1 4.46Å; A60-L65 HydrophobicContact CB-CD2 3.73Å; A60-L65 HydrophobicContact CB-CG 3.81Å; A60-L121 HydrophobicContact CB-CD1 3.88Å; A60-L121 HydrophobicContact CB-CD2 3.83Å
61	S	76.8	Confident	76.5	Confident	52 Å²	52	55.7 Å²	55.7	36%	0.364	30%	0.299	S	S	.	.			trans	-69.3	156.3	169.4	79.9	0	0	0	0	110.7	E63 Q64 L65	S61-E63 VanDerWaalsContact C-N 3.26Å; S61-E63 PolarHBondContact O-N 2.69Å; S61-Q64 WeakPolarHBondContact O-CB 3.33Å; S61-Q64 PolarHBondContact O-N 3.3Å; S61-Q64 VanDerWaalsContact OG-CG 3.29Å; S61-Q64 WeakPolarHBondContact OG-CG 3.29Å; S61-Q64 PolarHBondContact OG-N 2.95Å; S61-Q64 PolarHBondContact OG-OE1 3.23Å; S61-L65 WeakPolarHBondContact O-CG 3.48Å; S61-L65 PolarHBondContact O-N 3.21Å
62	R	68.8	Low	76.6	Confident	95 Å²	95	53.6 Å²	53.6	36%	0.358	28%	0.277	S	S	.	.	H	α-helix	trans	-54.8	-41.8	175.3	-171.2	178.4	-173.5	-80.2	-0.5	112.8	Q64 L65 L66 Q94 E224	R62-Q64 VanDerWaalsContact C-N 3.33Å; R62-Q64 PolarHBondContact O-N 3.45Å; R62-L65 PolarHBondContact O-N 3.13Å; R62-L66 VanDerWaalsContact O-CB 3.28Å; R62-L66 WeakPolarHBondContact O-CB 3.35Å; R62-L66 PolarHBondContact O-N 2.85Å; R62-Q94 VanDerWaalsContact CZ-OE1 3.24Å; R62-E224 WeakPolarHBondContact CD-OE1 3.37Å; R62-E224 IonicContact CZ-OE1 2.66Å; R62-E224 IonicContact NE-OE1 3.46Å; R62-E224 PolarHBondContact NE-OE1 3.09Å; R62-E224 IonicContact NE-OE2 3.03Å
63	E	74.3	Confident	76.1	Confident	159 Å²	159	54 Å²	54	74%	0.743	28%	0.278	S	S	*	.	H	α-helix	trans	-61.1	-40.9	175.3	-65.2	-179.3	170	0	0	112.2	S61 L66 Y67	S61-E63 VanDerWaalsContact C-N 3.26Å; S61-E63 PolarHBondContact O-N 2.69Å; E63-L66 PolarHBondContact O-N 3.43Å; E63-Y67 VanDerWaalsContact O-CB 3.3Å; E63-Y67 WeakPolarHBondContact O-CB 3.35Å; E63-Y67 PolarHBondContact O-N 2.74Å
64	Q	80.4	Confident	75.9	Confident	73 Å²	73	53.9 Å²	53.9	34%	0.341	28%	0.278	S	S	.	.	H	α-helix	trans	-67	-42.3	177.3	-70.2	169.1	-36.3	0	0	111.5	A60 S61 R62 L66 Y67 L68	A60-Q64 HydrophobicContact CB-CB 4.44Å; S61-Q64 WeakPolarHBondContact O-CB 3.33Å; S61-Q64 PolarHBondContact O-N 3.3Å; S61-Q64 VanDerWaalsContact OG-CG 3.29Å; S61-Q64 WeakPolarHBondContact OG-CG 3.29Å; S61-Q64 PolarHBondContact OG-N 2.95Å; S61-Q64 PolarHBondContact OG-OE1 3.23Å; R62-Q64 VanDerWaalsContact C-N 3.33Å; R62-Q64 PolarHBondContact O-N 3.45Å; Q64-L66 VanDerWaalsContact C-N 3.35Å; Q64-Y67 PolarHBondContact O-N 2.96Å; Q64-L68 WeakPolarHBondContact O-CB 3.19Å; Q64-L68 VanDerWaalsContact O-CG 3.28Å; Q64-L68 WeakPolarHBondContact O-CG 3.23Å; Q64-L68 PolarHBondContact O-N 3.49Å
65	L	76.9	Confident	76.3	Confident	49 Å²	49	51.2 Å²	51.2	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-63.1	-42.3	175.5	-68.8	174.3	0	0	0	111.4	L53 I57 A60 S61 R62 L68 Y69	L53-L65 HydrophobicContact CD1-CD2 4.12Å; I57-L65 HydrophobicContact CG2-CD1 4.27Å; A60-L65 HydrophobicContact CB-CD1 4.46Å; A60-L65 HydrophobicContact CB-CD2 3.73Å; A60-L65 HydrophobicContact CB-CG 3.81Å; S61-L65 WeakPolarHBondContact O-CG 3.48Å; S61-L65 PolarHBondContact O-N 3.21Å; R62-L65 PolarHBondContact O-N 3.13Å; L65-L68 PolarHBondContact O-N 2.96Å; L65-Y69 VanDerWaalsContact O-CB 3.28Å; L65-Y69 WeakPolarHBondContact O-CB 3.27Å; L65-Y69 PolarHBondContact O-N 2.98Å
66	L	72.5	Confident	76.4	Confident	30 Å²	30	52.8 Å²	52.8	16%	0.157	26%	0.257	C	S	.	.	H	α-helix	trans	-65.4	-41	178.3	-161.1	63.4	0	0	0	111.9	R62 E63 Q64 Y69 A70 K95 A98	R62-L66 VanDerWaalsContact O-CB 3.28Å; R62-L66 WeakPolarHBondContact O-CB 3.35Å; R62-L66 PolarHBondContact O-N 2.85Å; E63-L66 PolarHBondContact O-N 3.43Å; Q64-L66 VanDerWaalsContact C-N 3.35Å; L66-Y69 PolarHBondContact O-N 3.37Å; L66-A70 WeakPolarHBondContact O-CB 3.34Å; L66-A70 PolarHBondContact O-N 3.03Å; L66-K95 HydrophobicContact CD1-CB 4.09Å; L66-K95 HydrophobicContact CD1-CG 3.45Å; L66-K95 VanDerWaalsContact CD1-CG 3.45Å; L66-A98 HydrophobicContact CD1-CB 4.41Å; L66-A98 HydrophobicContact CD2-CB 3.36Å; L66-A98 HydrophobicContact CG-CB 3.47Å; L66-A98 VanDerWaalsContact CG-CB 3.47Å
67	Y	82.3	Confident	76	Confident	63 Å²	63	57 Å²	57	25%	0.247	28%	0.283	C	S	.	.	H	α-helix	trans	-63.6	-48.5	174.1	176	-90.2	0	0	0	112.1	E63 Q64 Y69 A70 R71 L102 E113 V117	E63-Y67 VanDerWaalsContact O-CB 3.3Å; E63-Y67 WeakPolarHBondContact O-CB 3.35Å; E63-Y67 PolarHBondContact O-N 2.74Å; Q64-Y67 PolarHBondContact O-N 2.96Å; Y67-Y69 VanDerWaalsContact C-N 3.32Å; Y67-Y69 PolarHBondContact O-N 3.29Å; Y67-A70 PolarHBondContact O-N 3.06Å; Y67-R71 HydrophobicContact CD1-CG 4.37Å; Y67-R71 HydrophobicContact CE1-CG 3.87Å; Y67-R71 HydrophobicContact CE2-CG 4.45Å; Y67-R71 PolarHBondContact O-N 2.96Å; Y67-L102 HydrophobicContact CD2-CD1 3.92Å; Y67-L102 HydrophobicContact CD2-CD2 3.64Å; Y67-L102 HydrophobicContact CD2-CG 4.4Å; Y67-L102 HydrophobicContact CE2-CD1 4.06Å; Y67-L102 HydrophobicContact CE2-CD2 3.54Å; Y67-L102 HydrophobicContact CE2-CG 4.48Å; Y67-E113 PolarHBondContact OH-OE2 3.36Å; Y67-V117 HydrophobicContact CD1-CG2 3.91Å; Y67-V117 HydrophobicContact CE1-CB 4.44Å; Y67-V117 HydrophobicContact CE1-CG2 3.5Å; Y67-V117 VanDerWaalsContact CE1-CG2 3.5Å
68	L	82.8	Confident	75.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.6	-44.4	176.8	-77.2	169.5	0	0	0	110.9	L53 Q64 L65 A70 R71 Y72 Y114 V117 V118 L121	L53-L68 HydrophobicContact CD1-CD1 3.49Å; L53-L68 VanDerWaalsContact CD1-CD1 3.49Å; L53-L68 HydrophobicContact CD2-CB 4.12Å; L53-L68 HydrophobicContact CD2-CD1 3.93Å; L53-L68 HydrophobicContact CG-CD1 4.39Å; Q64-L68 WeakPolarHBondContact O-CB 3.19Å; Q64-L68 VanDerWaalsContact O-CG 3.28Å; Q64-L68 WeakPolarHBondContact O-CG 3.23Å; Q64-L68 PolarHBondContact O-N 3.49Å; L65-L68 PolarHBondContact O-N 2.96Å; L68-A70 PolarHBondContact O-N 3.38Å; L68-R71 PolarHBondContact O-N 3.15Å; L68-Y72 WeakPolarHBondContact O-CB 3.41Å; L68-Y72 PolarHBondContact O-N 3.42Å; L68-Y114 HydrophobicContact CB-CD2 4.25Å; L68-Y114 HydrophobicContact CB-CE2 3.84Å; L68-Y114 HydrophobicContact CD2-CD1 4.32Å; L68-Y114 HydrophobicContact CD2-CD2 3.64Å; L68-Y114 HydrophobicContact CD2-CE1 4.38Å; L68-Y114 HydrophobicContact CD2-CE2 3.73Å; L68-Y114 HydrophobicContact CD2-CG 3.95Å; L68-Y114 HydrophobicContact CG-CE2 4.39Å; L68-Y114 VanDerWaalsContact O-CD2 3.26Å; L68-Y114 WeakPolarHBondContact O-CD2 3.38Å; L68-Y114 WeakPolarHBondContact O-CE2 3.33Å; L68-V117 HydrophobicContact CD1-CG1 3.93Å; L68-V117 HydrophobicContact CD2-CB 3.72Å; L68-V117 HydrophobicContact CD2-CG1 3.69Å; L68-V117 HydrophobicContact CG-CB 4.31Å; L68-V117 HydrophobicContact CG-CG1 3.75Å; L68-V118 HydrophobicContact CD2-CG2 3.96Å; L68-L121 HydrophobicContact CD1-CD1 3.71Å
69	Y	78.3	Confident	75.5	Confident	16 Å²	16	52.6 Å²	52.6	6%	0.063	27%	0.272	C	S	.	.	H	α-helix	trans	-56	-49.4	174.2	165.6	-98.4	0	0	0	111.6	L65 L66 Y67 R71 Y72 K73 K95 L149 Y150	L65-Y69 VanDerWaalsContact O-CB 3.28Å; L65-Y69 WeakPolarHBondContact O-CB 3.27Å; L65-Y69 PolarHBondContact O-N 2.98Å; L66-Y69 PolarHBondContact O-N 3.37Å; Y67-Y69 VanDerWaalsContact C-N 3.32Å; Y67-Y69 PolarHBondContact O-N 3.29Å; Y69-R71 PolarHBondContact O-N 3.24Å; Y69-Y72 WeakPolarHBondContact O-CB 3.48Å; Y69-Y72 PolarHBondContact O-N 3.41Å; Y69-K73 WeakPolarHBondContact O-CB 3.31Å; Y69-K73 PolarHBondContact O-N 3.09Å; Y69-K95 HydrophobicContact CD1-CB 4.1Å; Y69-K95 HydrophobicContact CD1-CD 4.4Å; Y69-K95 HydrophobicContact CD1-CG 3.93Å; Y69-K95 HydrophobicContact CE1-CB 3.7Å; Y69-K95 HydrophobicContact CE1-CD 4.15Å; Y69-K95 HydrophobicContact CE1-CG 3.9Å; Y69-L149 HydrophobicContact CD2-CD1 4.21Å; Y69-Y150 HydrophobicContact CD2-CE2 4.46Å; Y69-Y150 HydrophobicContact CE1-CE2 4.38Å; Y69-Y150 AromaticContact CE2-CD2 3.74Å; Y69-Y150 HydrophobicContact CE2-CD2 3.74Å; Y69-Y150 AromaticContact CE2-CE2 3.31Å; Y69-Y150 HydrophobicContact CE2-CE2 3.31Å; Y69-Y150 AromaticContact CZ-CE2 3.27Å; Y69-Y150 AromaticContact CZ-CZ 3.89Å; Y69-Y150 WeakPolarHBondContact OH-CE2 3.44Å; Y69-Y150 PolarHBondContact OH-OH 2.87Å
70	A	77.1	Confident	74.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-42.8	-179.6	0	0	0	0	0	112.3	L66 Y67 L68 K73 Q74 W99 L102	L66-A70 WeakPolarHBondContact O-CB 3.34Å; L66-A70 PolarHBondContact O-N 3.03Å; Y67-A70 PolarHBondContact O-N 3.06Å; L68-A70 PolarHBondContact O-N 3.38Å; A70-K73 PolarHBondContact O-N 2.8Å; A70-Q74 WeakPolarHBondContact O-CG 3.43Å; A70-Q74 PolarHBondContact O-N 2.98Å; A70-W99 HydrophobicContact CB-CB 3.94Å; A70-W99 HydrophobicContact CB-CG 4.26Å; A70-L102 HydrophobicContact CB-CD1 3.47Å; A70-L102 VanDerWaalsContact CB-CD1 3.47Å
71	R	82.4	Confident	73.8	Confident	15 Å²	15	52.9 Å²	52.9	6%	0.057	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-42.5	174.6	-70.6	-50.3	-170.9	-148.3	-4.5	112.1	Y67 L68 Y69 K73 Q74 V75 L102 S105 E113 Y114	Y67-R71 HydrophobicContact CD1-CG 4.37Å; Y67-R71 HydrophobicContact CE1-CG 3.87Å; Y67-R71 HydrophobicContact CE2-CG 4.45Å; Y67-R71 PolarHBondContact O-N 2.96Å; L68-R71 PolarHBondContact O-N 3.15Å; Y69-R71 PolarHBondContact O-N 3.24Å; R71-K73 VanDerWaalsContact C-N 3.3Å; R71-K73 PolarHBondContact O-N 3.47Å; R71-Q74 PolarHBondContact O-N 2.98Å; R71-V75 WeakPolarHBondContact O-CG2 3.29Å; R71-V75 PolarHBondContact O-N 3.47Å; R71-L102 HydrophobicContact CG-CD1 4.43Å; R71-S105 PolarHBondContact NH1-OG 2.89Å; R71-E113 HydrophobicContact CG-CB 4.45Å; R71-E113 IonicContact CZ-OE2 3.03Å; R71-E113 IonicContact NE-OE2 2.75Å; R71-E113 PolarHBondContact NE-OE2 2.59Å; R71-E113 IonicContact NH2-OE1 3.72Å; R71-E113 IonicContact NH2-OE2 2.64Å; R71-E113 PolarHBondContact NH2-OE2 3.38Å; R71-Y114 HydrophobicContact CB-CD2 4.1Å
72	Y	82.3	Confident	72.8	Confident	23 Å²	23	53 Å²	53	9%	0.09	27%	0.267	C	S	.	.	H	α-helix	trans	-58.2	-45.1	175	-178.9	-90.4	0	0	0	111.4	F46 A50 L68 Y69 Q74 V75 K76 Y114 I146	F46-Y72 AromaticContact CE1-CD2 3.96Å; F46-Y72 HydrophobicContact CE1-CD2 3.96Å; F46-Y72 HydrophobicContact CE1-CE2 4.01Å; F46-Y72 HydrophobicContact CE2-CD2 4.12Å; F46-Y72 AromaticContact CZ-CD2 3.31Å; F46-Y72 HydrophobicContact CZ-CD2 3.31Å; F46-Y72 AromaticContact CZ-CE2 3.84Å; F46-Y72 HydrophobicContact CZ-CE2 3.84Å; F46-Y72 HydrophobicContact CZ-CG 4.07Å; A50-Y72 HydrophobicContact CB-CD2 4.11Å; A50-Y72 HydrophobicContact CB-CE2 3.92Å; L68-Y72 WeakPolarHBondContact O-CB 3.41Å; L68-Y72 PolarHBondContact O-N 3.42Å; Y69-Y72 WeakPolarHBondContact O-CB 3.48Å; Y69-Y72 PolarHBondContact O-N 3.41Å; Y72-Q74 PolarHBondContact O-N 3.34Å; Y72-V75 PolarHBondContact O-N 3.3Å; Y72-K76 HydrophobicContact CD1-CG 4.15Å; Y72-K76 HydrophobicContact CE1-CG 3.7Å; Y72-K76 HydrophobicContact CE2-CG 4.32Å; Y72-K76 WeakPolarHBondContact O-CG 3.42Å; Y72-K76 PolarHBondContact O-N 2.99Å; Y72-K76 VanDerWaalsContact O-N 3.08Å; Y72-K76 WeakPolarHBondContact OH-CE 3.45Å; Y72-Y114 HydrophobicContact CD2-CE2 4.43Å; Y72-I146 HydrophobicContact CD1-CG2 4.04Å; Y72-I146 HydrophobicContact CD2-CD1 4.49Å; Y72-I146 HydrophobicContact CE1-CG2 3.76Å
73	K	74.4	Confident	72	Confident	42 Å²	42	54.2 Å²	54.2	18%	0.183	29%	0.287	C	S	.	.	H	α-helix	trans	-65.8	-38.5	-179.6	-151.1	-134.2	-171.3	-174.8	0	112.6	Y69 A70 R71 V75 K76 V77 W99	Y69-K73 WeakPolarHBondContact O-CB 3.31Å; Y69-K73 PolarHBondContact O-N 3.09Å; A70-K73 PolarHBondContact O-N 2.8Å; R71-K73 VanDerWaalsContact C-N 3.3Å; R71-K73 PolarHBondContact O-N 3.47Å; K73-V75 VanDerWaalsContact C-N 3.3Å; K73-V75 PolarHBondContact O-N 2.93Å; K73-K76 PolarHBondContact O-N 3.17Å; K73-V77 HydrophobicContact CG-CB 4.3Å; K73-V77 HydrophobicContact CG-CG2 3.94Å; K73-V77 WeakPolarHBondContact O-CA 3.49Å; K73-V77 WeakPolarHBondContact O-CB 3.35Å; K73-V77 PolarHBondContact O-N 3.41Å; K73-W99 HydrophobicContact CD-CD2 3.81Å; K73-W99 HydrophobicContact CD-CE3 3.95Å; K73-W99 HydrophobicContact CD-CH2 3.74Å; K73-W99 HydrophobicContact CD-CZ2 3.51Å; K73-W99 HydrophobicContact CD-CZ3 3.95Å
74	Q	75.5	Confident	70.9	Confident	7 Å²	7	52.5 Å²	52.5	3%	0.033	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-40.4	173.3	-75.4	179.6	-49.3	0	0	112.5	A70 R71 Y72 G78 C80 G103 S105 A110	A70-Q74 WeakPolarHBondContact O-CG 3.43Å; A70-Q74 PolarHBondContact O-N 2.98Å; R71-Q74 PolarHBondContact O-N 2.98Å; Y72-Q74 PolarHBondContact O-N 3.34Å; Q74-G78 WeakPolarHBondContact CA-O 3.45Å; Q74-G78 WeakPolarHBondContact O-CA 3.24Å; Q74-G78 PolarHBondContact O-N 3.45Å; Q74-G78 VanDerWaalsContact O-N 3.14Å; Q74-C80 VanDerWaalsContact CD-SG 3.58Å; Q74-C80 WeakPolarHBondContact CG-SG 3.29Å; Q74-C80 PolarHBondContact NE2-SG 3.48Å; Q74-G103 PolarHBondContact NE2-O 3Å; Q74-S105 PolarHBondContact NE2-OG 2.95Å; Q74-S105 PolarHBondContact OE1-OG 3.33Å; Q74-A110 HydrophobicContact CB-CB 4.1Å
75	V	77.8	Confident	69.7	Low	32 Å²	32	52 Å²	52	19%	0.194	28%	0.28	C	S	.	.	H	α-helix	trans	-67.9	-40.4	179	176.9	0	0	0	0	111.3	F46 R71 Y72 K73 A110 M111	F46-V75 HydrophobicContact CD1-CG1 4.13Å; F46-V75 HydrophobicContact CE1-CB 4.18Å; F46-V75 HydrophobicContact CE1-CG1 3.7Å; F46-V75 HydrophobicContact CE2-CB 4.29Å; F46-V75 HydrophobicContact CE2-CG1 4.44Å; F46-V75 HydrophobicContact CE2-CG2 4.01Å; F46-V75 HydrophobicContact CZ-CB 3.81Å; F46-V75 HydrophobicContact CZ-CG1 3.85Å; F46-V75 HydrophobicContact CZ-CG2 4.05Å; R71-V75 WeakPolarHBondContact O-CG2 3.29Å; R71-V75 PolarHBondContact O-N 3.47Å; Y72-V75 PolarHBondContact O-N 3.3Å; K73-V75 VanDerWaalsContact C-N 3.3Å; K73-V75 PolarHBondContact O-N 2.93Å; V75-A110 HydrophobicContact CG2-CB 3.63Å; V75-M111 HydrophobicContact CB-CG 4.3Å; V75-M111 HydrophobicContact CG1-CE 4.33Å; V75-M111 HydrophobicContact CG1-CG 3.7Å; V75-M111 HydrophobicContact CG1-SD 4.09Å; V75-M111 HydrophobicContact CG2-CB 4.43Å; V75-M111 HydrophobicContact CG2-CG 3.52Å
76	K	76.1	Confident	68	Low	95 Å²	95	56.4 Å²	56.4	41%	0.413	32%	0.315	S	S	.	.	H	α-helix	trans	-86.4	-37.8	-174.5	-66.3	-60.3	-170.6	179.9	0	114.8	E47 Y72 K73	E47-K76 WeakPolarHBondContact OE1-CE 3.39Å; E47-K76 IonicContact OE1-NZ 2.54Å; E47-K76 PolarHBondContact OE1-NZ 2.78Å; E47-K76 IonicContact OE2-NZ 3.73Å; Y72-K76 HydrophobicContact CD1-CG 4.15Å; Y72-K76 HydrophobicContact CE1-CG 3.7Å; Y72-K76 HydrophobicContact CE2-CG 4.32Å; Y72-K76 WeakPolarHBondContact O-CG 3.42Å; Y72-K76 PolarHBondContact O-N 2.99Å; Y72-K76 VanDerWaalsContact O-N 3.08Å; Y72-K76 WeakPolarHBondContact OH-CE 3.45Å; K73-K76 PolarHBondContact O-N 3.17Å
77	V	68.1	Low	66.7	Low	99 Å²	99	60.5 Å²	60.5	60%	0.6	33%	0.332	S	S	*	.	H	α-helix	trans	-112.9	-18.2	-167.6	-171.6	0	0	0	0	111.8	K73	K73-V77 HydrophobicContact CG-CB 4.3Å; K73-V77 HydrophobicContact CG-CG2 3.94Å; K73-V77 WeakPolarHBondContact O-CA 3.49Å; K73-V77 WeakPolarHBondContact O-CB 3.35Å; K73-V77 PolarHBondContact O-N 3.41Å
78	G	67.3	Low	65.4	Low	27 Å²	27	59.2 Å²	59.2	28%	0.278	33%	0.327	S	S	.	.			trans	95.2	-154.6	179.5	0	0	0	0	0	113.8	Q74	Q74-G78 WeakPolarHBondContact CA-O 3.45Å; Q74-G78 WeakPolarHBondContact O-CA 3.24Å; Q74-G78 PolarHBondContact O-N 3.45Å; Q74-G78 VanDerWaalsContact O-N 3.14Å
79	N	62.3	Low	64.3	Low	110 Å²	110	60.8 Å²	60.8	59%	0.588	34%	0.336	S	S	*	.			trans	-54.9	150.7	-166.6	-66.4	49.7	0	0	0	115	W99 D104	N79-W99 WeakPolarHBondContact O-CZ2 3.33Å; N79-D104 PolarHBondContact ND2-OD2 3.07Å
80	C	55.9	Low	63.3	Low	3 Å²	3	60.9 Å²	60.9	2%	0.02	34%	0.337	C	S	.	.	S	Bend	trans	-81.1	-17.6	-175.6	-47.4	0	0	0	0	113.2	Q74 T82 W99 G103 D104	Q74-C80 VanDerWaalsContact CD-SG 3.58Å; Q74-C80 WeakPolarHBondContact CG-SG 3.29Å; Q74-C80 PolarHBondContact NE2-SG 3.48Å; C80-T82 PolarHBondContact O-N 3.01Å; C80-W99 HydrophobicContact CB-CZ2 4.38Å; C80-W99 PolarHBondContact SG-NE1 3.39Å; C80-G103 PolarHBondContact SG-O 2.8Å; C80-D104 WeakPolarHBondContact CB-OD1 3.49Å; C80-D104 PolarHBondContact N-OD1 2.69Å
81	N	56.6	Low	62.6	Low	120 Å²	120	63 Å²	63	64%	0.642	35%	0.347	S	S	*	.			trans	-79.2	46	-179.7	-74.8	-46.4	0	0	0	112.8	D104	N81-D104 PolarHBondContact ND2-OD2 2.78Å
82	T	56.3	Low	61.9	Low	56 Å²	56	62.4 Å²	62.4	34%	0.344	35%	0.345	S	S	.	.			trans	-85	136.3	169.4	57.8	0	0	0	0	109.8	C80 K84 W99	C80-T82 PolarHBondContact O-N 3.01Å; T82-K84 PolarHBondContact O-N 3.48Å; T82-W99 HydrophobicContact CG2-CH2 4.02Å; T82-W99 WeakPolarHBondContact OG1-CH2 3.27Å; T82-W99 VanDerWaalsContact OG1-CZ3 3.26Å; T82-W99 WeakPolarHBondContact OG1-CZ3 3.29Å
83	P	52.3	Low	61.1	Low	119 Å²	119	63.2 Å²	63.2	77%	0.773	35%	0.349	S	S	*	.			trans	-55.8	141.7	174	23.8	-31.9	0	0	0	109.7	P85	P83-P85 WeakPolarHBondContact O-CD 3.32Å; P83-P85 VanDerWaalsContact O-N 3.1Å
84	K	51.2	Low	60.7	Low	123 Å²	123	63.1 Å²	63.1	54%	0.535	35%	0.349	S	S	.	.			trans	-48.7	115.7	-179.8	-172.1	-175.5	177.1	179.9	0	109.3	T82 F88 W96	T82-K84 PolarHBondContact O-N 3.48Å; K84-F88 HydrophobicContact CB-CE2 4.35Å; K84-F88 HydrophobicContact CD-CD2 4.37Å; K84-F88 HydrophobicContact CD-CE2 4.48Å; K84-F88 HydrophobicContact CG-CD2 3.67Å; K84-F88 HydrophobicContact CG-CE2 3.4Å; K84-W96 HydrophobicContact CB-CH2 4.31Å; K84-W96 HydrophobicContact CB-CZ2 3.94Å; K84-W96 HydrophobicContact CG-CH2 4.43Å; K84-W96 HydrophobicContact CG-CZ2 4.33Å
85	P	54.3	Low	60.2	Low	64 Å²	64	63.4 Å²	63.4	42%	0.416	35%	0.35	S	S	.	.			trans	-43.5	141	167.5	-30.5	26.1	0	0	0	112.4	P83 F87 F88	P83-P85 WeakPolarHBondContact O-CD 3.32Å; P83-P85 VanDerWaalsContact O-N 3.1Å; P85-F87 PolarHBondContact O-N 3.36Å; P85-F87 VanDerWaalsContact O-N 3.13Å; P85-F88 HydrophobicContact CB-CD2 4.22Å; P85-F88 HydrophobicContact CB-CE2 3.74Å; P85-F88 HydrophobicContact CB-CZ 4.06Å; P85-F88 VanDerWaalsContact CD-CZ 3.47Å; P85-F88 HydrophobicContact CG-CE1 4.39Å; P85-F88 HydrophobicContact CG-CE2 3.63Å; P85-F88 HydrophobicContact CG-CZ 3.54Å; P85-F88 WeakPolarHBondContact O-CD2 3.48Å
86	S	41.2	Very low	59.7	Low	141 Å²	141	63.6 Å²	63.6	99%	0.986	35%	0.348	S	S	*	.	S	Bend	trans	-62.8	-19.5	-177	-48.5	0	0	0	0	113.2
87	F	45.2	Very low	59.4	Low	116 Å²	116	63.7 Å²	63.7	51%	0.509	35%	0.349	S	S	.	.			trans	-128.7	129.7	176.4	-177.8	-101.5	0	0	0	109.6	P85	P85-F87 PolarHBondContact O-N 3.36Å; P85-F87 VanDerWaalsContact O-N 3.13Å
88	F	55.5	Low	59.4	Low	35 Å²	35	60.1 Å²	60.1	15%	0.154	33%	0.331	C	S	.	.			trans	-135.6	123.8	172.6	-92.1	-69.5	0	0	0	108	K84 P85 G92 K93 W96	K84-F88 HydrophobicContact CB-CE2 4.35Å; K84-F88 HydrophobicContact CD-CD2 4.37Å; K84-F88 HydrophobicContact CD-CE2 4.48Å; K84-F88 HydrophobicContact CG-CD2 3.67Å; K84-F88 HydrophobicContact CG-CE2 3.4Å; P85-F88 HydrophobicContact CB-CD2 4.22Å; P85-F88 HydrophobicContact CB-CE2 3.74Å; P85-F88 HydrophobicContact CB-CZ 4.06Å; P85-F88 VanDerWaalsContact CD-CZ 3.47Å; P85-F88 HydrophobicContact CG-CE1 4.39Å; P85-F88 HydrophobicContact CG-CE2 3.63Å; P85-F88 HydrophobicContact CG-CZ 3.54Å; P85-F88 WeakPolarHBondContact O-CD2 3.48Å; F88-G92 VanDerWaalsContact CD1-O 3.28Å; F88-G92 WeakPolarHBondContact CD1-O 3.45Å; F88-G92 VanDerWaalsContact CE1-C 3.48Å; F88-G92 WeakPolarHBondContact CE1-O 3.46Å; F88-K93 HydrophobicContact CB-CB 4.31Å; F88-K93 VanDerWaalsContact CD1-N 3.35Å; F88-W96 HydrophobicContact CD1-CB 4.39Å; F88-W96 HydrophobicContact CE1-CB 3.39Å; F88-W96 AromaticContact CE1-CG 3.97Å; F88-W96 HydrophobicContact CE1-CG 3.97Å; F88-W96 HydrophobicContact CE2-CB 4.29Å; F88-W96 HydrophobicContact CE2-CD2 4.33Å; F88-W96 HydrophobicContact CE2-CG 4.02Å; F88-W96 HydrophobicContact CZ-CB 3.31Å; F88-W96 AromaticContact CZ-CD1 3.5Å; F88-W96 HydrophobicContact CZ-CD2 4.08Å; F88-W96 AromaticContact CZ-CG 3.32Å; F88-W96 HydrophobicContact CZ-CG 3.32Å
89	D	59.5	Low	59.4	Low	34 Å²	34	59 Å²	59	18%	0.182	32%	0.318	C	S	.	.			trans	-71	165	157.6	45.9	23.1	0	0	0	109.6	E91 G92 K93 D201 R202	D89-E91 PolarHBondContact O-N 3.31Å; D89-G92 PolarHBondContact O-N 2.96Å; D89-G92 VanDerWaalsContact O-N 3.15Å; D89-G92 WeakPolarHBondContact OD1-CA 3.36Å; D89-G92 PolarHBondContact OD1-N 3.44Å; D89-K93 PolarHBondContact O-N 2.88Å; D89-D201 WeakPolarHBondContact CB-OD2 3.13Å; D89-R202 IonicContact OD2-CZ 2.79Å; D89-R202 IonicContact OD2-NH1 2.92Å; D89-R202 PolarHBondContact OD2-NH1 3.1Å; D89-R202 IonicContact OD2-NH2 3.08Å
90	F	58.2	Low	59.8	Low	18 Å²	18	59.2 Å²	59.2	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-54.4	-43.6	-178.8	178.6	-113.6	0	0	0	111.2	K93 Q94 D201 Y231 A234 C235	F90-K93 PolarHBondContact O-N 3.1Å; F90-Q94 WeakPolarHBondContact O-CG 3.28Å; F90-Q94 PolarHBondContact O-N 3.08Å; F90-Q94 VanDerWaalsContact O-N 3.12Å; F90-D201 WeakPolarHBondContact CA-OD1 3.48Å; F90-D201 WeakPolarHBondContact CB-OD1 3.35Å; F90-D201 PolarHBondContact N-OD1 3.19Å; F90-Y231 HydrophobicContact CB-CD1 3.9Å; F90-Y231 HydrophobicContact CB-CE1 4.31Å; F90-Y231 AromaticContact CD1-CD1 3.71Å; F90-Y231 HydrophobicContact CD1-CD1 3.71Å; F90-Y231 AromaticContact CD1-CE1 3.46Å; F90-Y231 HydrophobicContact CD1-CE1 3.46Å; F90-Y231 VanDerWaalsContact CD1-CE1 3.46Å; F90-Y231 HydrophobicContact CE1-CD1 4.39Å; F90-Y231 HydrophobicContact CE1-CE1 4.02Å; F90-Y231 AromaticContact CG-CD1 3.92Å; F90-Y231 HydrophobicContact CG-CD1 3.92Å; F90-Y231 HydrophobicContact CG-CE1 4.14Å; F90-A234 HydrophobicContact CD2-CB 3.37Å; F90-A234 HydrophobicContact CE2-CB 3.3Å; F90-C235 PolarHBondContact N-SG 3.26Å
91	E	63	Low	60.7	Low	44 Å²	44	63.1 Å²	63.1	21%	0.206	35%	0.346	C	S	.	.	H	α-helix	trans	-69.4	-41.3	179.3	-153.9	-174.7	135.5	0	0	111.6	D89 K93 Q94 K95 L149 R193	D89-E91 PolarHBondContact O-N 3.31Å; E91-K93 VanDerWaalsContact C-N 3.33Å; E91-K93 PolarHBondContact O-N 3.42Å; E91-Q94 PolarHBondContact O-N 3.18Å; E91-K95 WeakPolarHBondContact O-CB 3.5Å; E91-K95 VanDerWaalsContact O-CG 3.23Å; E91-K95 WeakPolarHBondContact O-CG 3.18Å; E91-K95 PolarHBondContact O-N 3.43Å; E91-K95 WeakPolarHBondContact OE1-CE 3.39Å; E91-K95 IonicContact OE1-NZ 2.65Å; E91-K95 PolarHBondContact OE1-NZ 2.95Å; E91-L149 WeakPolarHBondContact OE1-CD2 3.42Å; E91-R193 IonicContact OE2-CZ 3.8Å; E91-R193 IonicContact OE2-NH1 3.68Å; E91-R193 PolarHBondContact OE2-NH1 2.95Å
92	G	66.6	Low	61.6	Low	2 Å²	2	59.8 Å²	59.8	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-38.5	173.8	0	0	0	0	0	112.4	F88 D89 K95 W96	F88-G92 VanDerWaalsContact CD1-O 3.28Å; F88-G92 WeakPolarHBondContact CD1-O 3.45Å; F88-G92 VanDerWaalsContact CE1-C 3.48Å; F88-G92 WeakPolarHBondContact CE1-O 3.46Å; D89-G92 PolarHBondContact O-N 2.96Å; D89-G92 VanDerWaalsContact O-N 3.15Å; D89-G92 WeakPolarHBondContact OD1-CA 3.36Å; D89-G92 PolarHBondContact OD1-N 3.44Å; G92-K95 PolarHBondContact O-N 3Å; G92-W96 VanDerWaalsContact O-CB 3.32Å; G92-W96 WeakPolarHBondContact O-CB 3.37Å; G92-W96 PolarHBondContact O-N 3.29Å
93	K	66.7	Low	62.5	Low	41 Å²	41	58.6 Å²	58.6	18%	0.178	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-49.2	175.7	-178.5	-175.1	174.9	-171.2	0	110.2	F88 D89 F90 E91 K95 W96 E97 A234	F88-K93 HydrophobicContact CB-CB 4.31Å; F88-K93 VanDerWaalsContact CD1-N 3.35Å; D89-K93 PolarHBondContact O-N 2.88Å; F90-K93 PolarHBondContact O-N 3.1Å; E91-K93 VanDerWaalsContact C-N 3.33Å; E91-K93 PolarHBondContact O-N 3.42Å; K93-K95 PolarHBondContact O-N 3Å; K93-W96 PolarHBondContact O-N 3.19Å; K93-E97 WeakPolarHBondContact CE-OE1 3.3Å; K93-E97 HydrophobicContact CG-CG 4.47Å; K93-E97 WeakPolarHBondContact O-CB 3.42Å; K93-E97 WeakPolarHBondContact O-CG 3.29Å; K93-E97 PolarHBondContact O-N 2.91Å; K93-A234 PolarHBondContact NZ-O 3.47Å; K93-A234 VanDerWaalsContact NZ-O 3.11Å
94	Q	65.4	Low	63.7	Low	39 Å²	39	56.4 Å²	56.4	18%	0.182	31%	0.308	C	S	.	.	H	α-helix	trans	-62	-42.5	177.2	-69.9	-170.9	65.1	0	0	112.1	R62 F90 E91 W96 E97 A98	R62-Q94 VanDerWaalsContact CZ-OE1 3.24Å; F90-Q94 WeakPolarHBondContact O-CG 3.28Å; F90-Q94 PolarHBondContact O-N 3.08Å; F90-Q94 VanDerWaalsContact O-N 3.12Å; E91-Q94 PolarHBondContact O-N 3.18Å; Q94-W96 VanDerWaalsContact C-N 3.34Å; Q94-W96 PolarHBondContact O-N 3.37Å; Q94-E97 PolarHBondContact O-N 3.45Å; Q94-A98 WeakPolarHBondContact O-CB 3.43Å; Q94-A98 PolarHBondContact O-N 3.05Å
95	K	64.6	Low	65	Low	14 Å²	14	52.1 Å²	52.1	6%	0.061	29%	0.294	C	S	.	.	H	α-helix	trans	-58.5	-43.9	172.8	-76.7	167.8	-175.2	163.2	0	112.3	L66 Y69 E91 G92 K93 W99 Y150	L66-K95 HydrophobicContact CD1-CB 4.09Å; L66-K95 HydrophobicContact CD1-CG 3.45Å; L66-K95 VanDerWaalsContact CD1-CG 3.45Å; Y69-K95 HydrophobicContact CD1-CB 4.1Å; Y69-K95 HydrophobicContact CD1-CD 4.4Å; Y69-K95 HydrophobicContact CD1-CG 3.93Å; Y69-K95 HydrophobicContact CE1-CB 3.7Å; Y69-K95 HydrophobicContact CE1-CD 4.15Å; Y69-K95 HydrophobicContact CE1-CG 3.9Å; E91-K95 WeakPolarHBondContact O-CB 3.5Å; E91-K95 VanDerWaalsContact O-CG 3.23Å; E91-K95 WeakPolarHBondContact O-CG 3.18Å; E91-K95 PolarHBondContact O-N 3.43Å; E91-K95 WeakPolarHBondContact OE1-CE 3.39Å; E91-K95 IonicContact OE1-NZ 2.65Å; E91-K95 PolarHBondContact OE1-NZ 2.95Å; G92-K95 PolarHBondContact O-N 3Å; K93-K95 PolarHBondContact O-N 3Å; K95-W99 WeakPolarHBondContact O-CB 3.5Å; K95-W99 PolarHBondContact O-N 3.27Å; K95-Y150 HydrophobicContact CD-CE2 4.39Å
96	W	68.4	Low	66.5	Low	36 Å²	36	52.1 Å²	52.1	14%	0.136	30%	0.296	C	S	.	.	H	α-helix	trans	-71.5	-39	178.9	178.2	85.4	0	0	0	112.4	K84 F88 G92 K93 Q94 W99 K100	K84-W96 HydrophobicContact CB-CH2 4.31Å; K84-W96 HydrophobicContact CB-CZ2 3.94Å; K84-W96 HydrophobicContact CG-CH2 4.43Å; K84-W96 HydrophobicContact CG-CZ2 4.33Å; F88-W96 HydrophobicContact CD1-CB 4.39Å; F88-W96 HydrophobicContact CE1-CB 3.39Å; F88-W96 AromaticContact CE1-CG 3.97Å; F88-W96 HydrophobicContact CE1-CG 3.97Å; F88-W96 HydrophobicContact CE2-CB 4.29Å; F88-W96 HydrophobicContact CE2-CD2 4.33Å; F88-W96 HydrophobicContact CE2-CG 4.02Å; F88-W96 HydrophobicContact CZ-CB 3.31Å; F88-W96 AromaticContact CZ-CD1 3.5Å; F88-W96 HydrophobicContact CZ-CD2 4.08Å; F88-W96 AromaticContact CZ-CG 3.32Å; F88-W96 HydrophobicContact CZ-CG 3.32Å; G92-W96 VanDerWaalsContact O-CB 3.32Å; G92-W96 WeakPolarHBondContact O-CB 3.37Å; G92-W96 PolarHBondContact O-N 3.29Å; K93-W96 PolarHBondContact O-N 3.19Å; Q94-W96 VanDerWaalsContact C-N 3.34Å; Q94-W96 PolarHBondContact O-N 3.37Å; W96-W99 PolarHBondContact O-N 3.29Å; W96-K100 HydrophobicContact CH2-CD 3.59Å; W96-K100 HydrophobicContact CZ2-CD 3.77Å; W96-K100 HydrophobicContact CZ3-CD 4.03Å; W96-K100 WeakPolarHBondContact O-CB 3.31Å; W96-K100 PolarHBondContact O-N 3.3Å
97	E	69.1	Low	68.5	Low	96 Å²	96	48.9 Å²	48.9	45%	0.449	27%	0.271	S	S	.	.	H	α-helix	trans	-63.6	-46.6	175.6	-75.3	175.1	176.8	0	0	111.1	K93 Q94 K100 A101	K93-E97 WeakPolarHBondContact CE-OE1 3.3Å; K93-E97 HydrophobicContact CG-CG 4.47Å; K93-E97 WeakPolarHBondContact O-CB 3.42Å; K93-E97 WeakPolarHBondContact O-CG 3.29Å; K93-E97 PolarHBondContact O-N 2.91Å; Q94-E97 PolarHBondContact O-N 3.45Å; E97-K100 PolarHBondContact O-N 2.93Å; E97-A101 VanDerWaalsContact O-CB 3.32Å; E97-A101 WeakPolarHBondContact O-CB 3.32Å; E97-A101 PolarHBondContact O-N 3.04Å
98	A	67.2	Low	70.5	Confident	25 Å²	25	45.7 Å²	45.7	21%	0.207	26%	0.263	C	S	.	.	H	α-helix	trans	-62.9	-43.6	173.9	0	0	0	0	0	112	L66 Q94 K100 A101 L102	L66-A98 HydrophobicContact CD1-CB 4.41Å; L66-A98 HydrophobicContact CD2-CB 3.36Å; L66-A98 HydrophobicContact CG-CB 3.47Å; L66-A98 VanDerWaalsContact CG-CB 3.47Å; Q94-A98 WeakPolarHBondContact O-CB 3.43Å; Q94-A98 PolarHBondContact O-N 3.05Å; A98-K100 VanDerWaalsContact C-N 3.34Å; A98-K100 PolarHBondContact O-N 3.11Å; A98-A101 PolarHBondContact O-N 3.48Å; A98-L102 WeakPolarHBondContact O-CG 3.48Å; A98-L102 PolarHBondContact O-N 3.37Å
99	W	67.1	Low	72.1	Confident	3 Å²	3	47.8 Å²	47.8	1%	0.011	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-39.9	177	-177.1	39.4	0	0	0	112.5	A70 K73 N79 C80 T82 K95 W96	A70-W99 HydrophobicContact CB-CB 3.94Å; A70-W99 HydrophobicContact CB-CG 4.26Å; K73-W99 HydrophobicContact CD-CD2 3.81Å; K73-W99 HydrophobicContact CD-CE3 3.95Å; K73-W99 HydrophobicContact CD-CH2 3.74Å; K73-W99 HydrophobicContact CD-CZ2 3.51Å; K73-W99 HydrophobicContact CD-CZ3 3.95Å; N79-W99 WeakPolarHBondContact O-CZ2 3.33Å; C80-W99 HydrophobicContact CB-CZ2 4.38Å; C80-W99 PolarHBondContact SG-NE1 3.39Å; T82-W99 HydrophobicContact CG2-CH2 4.02Å; T82-W99 WeakPolarHBondContact OG1-CH2 3.27Å; T82-W99 VanDerWaalsContact OG1-CZ3 3.26Å; T82-W99 WeakPolarHBondContact OG1-CZ3 3.29Å; K95-W99 WeakPolarHBondContact O-CB 3.5Å; K95-W99 PolarHBondContact O-N 3.27Å; W96-W99 PolarHBondContact O-N 3.29Å
100	K	71.8	Confident	73.4	Confident	114 Å²	114	46.1 Å²	46.1	50%	0.496	27%	0.265	S	S	.	.	H	α-helix	trans	-68.7	-37.2	174.8	-174.3	176.8	-179.9	-176.9	0	112.4	W96 E97 A98 L102 G103	W96-K100 HydrophobicContact CH2-CD 3.59Å; W96-K100 HydrophobicContact CZ2-CD 3.77Å; W96-K100 HydrophobicContact CZ3-CD 4.03Å; W96-K100 WeakPolarHBondContact O-CB 3.31Å; W96-K100 PolarHBondContact O-N 3.3Å; E97-K100 PolarHBondContact O-N 2.93Å; A98-K100 VanDerWaalsContact C-N 3.34Å; A98-K100 PolarHBondContact O-N 3.11Å; K100-L102 PolarHBondContact O-N 3.03Å; K100-G103 PolarHBondContact O-N 3.4Å
101	A	74.8	Confident	74.9	Confident	86 Å²	86	46 Å²	46	71%	0.711	27%	0.265	S	S	*	.	H	α-helix	trans	-63.6	-26.9	179.4	0	0	0	0	0	113	E97 A98 G103	E97-A101 VanDerWaalsContact O-CB 3.32Å; E97-A101 WeakPolarHBondContact O-CB 3.32Å; E97-A101 PolarHBondContact O-N 3.04Å; A98-A101 PolarHBondContact O-N 3.48Å; A101-G103 VanDerWaalsContact C-N 3.33Å; A101-G103 PolarHBondContact O-N 2.88Å
102	L	75.7	Confident	76.2	Confident	50 Å²	50	48.9 Å²	48.9	26%	0.262	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-18.7	179	-68.2	-176.4	0	0	0	114.9	Y67 A70 R71 A98 K100	Y67-L102 HydrophobicContact CD2-CD1 3.92Å; Y67-L102 HydrophobicContact CD2-CD2 3.64Å; Y67-L102 HydrophobicContact CD2-CG 4.4Å; Y67-L102 HydrophobicContact CE2-CD1 4.06Å; Y67-L102 HydrophobicContact CE2-CD2 3.54Å; Y67-L102 HydrophobicContact CE2-CG 4.48Å; A70-L102 HydrophobicContact CB-CD1 3.47Å; A70-L102 VanDerWaalsContact CB-CD1 3.47Å; R71-L102 HydrophobicContact CG-CD1 4.43Å; A98-L102 WeakPolarHBondContact O-CG 3.48Å; A98-L102 PolarHBondContact O-N 3.37Å; K100-L102 PolarHBondContact O-N 3.03Å
103	G	74.4	Confident	77.3	Confident	30 Å²	30	50.8 Å²	50.8	31%	0.309	29%	0.286	S	S	.	.			trans	66.1	174.6	-175.1	0	0	0	0	0	113.9	Q74 C80 K100 A101	Q74-G103 PolarHBondContact NE2-O 3Å; C80-G103 PolarHBondContact SG-O 2.8Å; K100-G103 PolarHBondContact O-N 3.4Å; A101-G103 VanDerWaalsContact C-N 3.33Å; A101-G103 PolarHBondContact O-N 2.88Å
104	D	77.8	Confident	78.4	Confident	73 Å²	73	48.8 Å²	48.8	39%	0.39	28%	0.278	S	S	.	.			trans	-72.8	132.2	177.7	-73.5	-20.1	0	0	0	110.9	N79 C80 N81	N79-D104 PolarHBondContact ND2-OD2 3.07Å; C80-D104 WeakPolarHBondContact CB-OD1 3.49Å; C80-D104 PolarHBondContact N-OD1 2.69Å; N81-D104 PolarHBondContact ND2-OD2 2.78Å
105	S	79.6	Confident	79.6	Confident	33 Å²	33	47.6 Å²	47.6	23%	0.231	27%	0.272	C	S	.	.			trans	-131.8	155.9	172.6	60.9	0	0	0	0	109.8	R71 Q74	R71-S105 PolarHBondContact NH1-OG 2.89Å; Q74-S105 PolarHBondContact NE2-OG 2.95Å; Q74-S105 PolarHBondContact OE1-OG 3.33Å
106	S	85.8	Confident	80.8	Confident	65 Å²	65	49 Å²	49	46%	0.455	29%	0.287	S	S	.	.			trans	-64.3	151.6	172.9	68.2	0	0	0	0	110.6	S108 Q109 A110	S106-S108 PolarHBondContact O-N 3.47Å; S106-Q109 PolarHBondContact O-N 2.65Å; S106-Q109 VanDerWaalsContact O-N 3.11Å; S106-Q109 VanDerWaalsContact OG-CB 3.31Å; S106-Q109 WeakPolarHBondContact OG-CB 3.48Å; S106-Q109 PolarHBondContact OG-N 3.22Å; S106-A110 PolarHBondContact O-N 3.38Å
107	P	82.4	Confident	81.8	Confident	72 Å²	72	48.2 Å²	48.2	47%	0.468	29%	0.286	S	S	.	.	H	α-helix	trans	-54	-40.7	176.1	-28.2	35.7	0	0	0	112.7	Q109 A110 M111	P107-Q109 PolarHBondContact O-N 2.85Å; P107-A110 PolarHBondContact O-N 2.85Å; P107-M111 HydrophobicContact CB-CE 3.94Å; P107-M111 WeakPolarHBondContact O-CB 3.38Å; P107-M111 WeakPolarHBondContact O-CE 3.48Å; P107-M111 VanDerWaalsContact O-CG 3.31Å; P107-M111 WeakPolarHBondContact O-CG 3.35Å; P107-M111 PolarHBondContact O-N 3.14Å
108	S	87.1	Confident	82.7	Confident	49 Å²	49	43.7 Å²	43.7	34%	0.343	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-42.4	177.4	-46.5	0	0	0	0	112.5	S106 M111 Q112	S106-S108 PolarHBondContact O-N 3.47Å; S108-M111 PolarHBondContact O-N 3.06Å; S108-Q112 WeakPolarHBondContact O-CB 3.47Å; S108-Q112 VanDerWaalsContact O-CG 3.29Å; S108-Q112 WeakPolarHBondContact O-CG 3.05Å; S108-Q112 PolarHBondContact O-N 3.08Å
109	Q	88.3	Confident	83.8	Confident	79 Å²	79	47.3 Å²	47.3	37%	0.369	28%	0.276	S	S	.	.	H	α-helix	trans	-64.4	-44.3	176.1	-175.8	65	31.2	0	0	111.2	S106 P107 M111 Q112 E113	S106-Q109 PolarHBondContact O-N 2.65Å; S106-Q109 VanDerWaalsContact O-N 3.11Å; S106-Q109 VanDerWaalsContact OG-CB 3.31Å; S106-Q109 WeakPolarHBondContact OG-CB 3.48Å; S106-Q109 PolarHBondContact OG-N 3.22Å; P107-Q109 PolarHBondContact O-N 2.85Å; Q109-M111 PolarHBondContact O-N 3.01Å; Q109-Q112 PolarHBondContact O-N 3.24Å; Q109-E113 WeakPolarHBondContact CG-OE1 3.5Å; Q109-E113 PolarHBondContact NE2-OE1 3.36Å; Q109-E113 WeakPolarHBondContact O-CB 3.31Å; Q109-E113 WeakPolarHBondContact O-CG 3.21Å; Q109-E113 PolarHBondContact O-N 3.23Å
110	A	87.7	Confident	84.9	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-41.3	178.2	0	0	0	0	0	112.2	Q74 V75 S106 P107 Y114	Q74-A110 HydrophobicContact CB-CB 4.1Å; V75-A110 HydrophobicContact CG2-CB 3.63Å; S106-A110 PolarHBondContact O-N 3.38Å; P107-A110 PolarHBondContact O-N 2.85Å; A110-Y114 WeakPolarHBondContact O-CB 3.2Å; A110-Y114 PolarHBondContact O-N 3.48Å
111	M	89.1	Confident	85.7	Confident	15 Å²	15	50.7 Å²	50.7	7%	0.074	29%	0.292	C	S	.	.	H	α-helix	trans	-61.7	-46.9	174.3	-74.2	-176.4	-98.6	0	0	111.8	L42 A43 F46 V75 P107 S108 Q109 E113 Y114 I115	L42-M111 HydrophobicContact CD1-CB 4.18Å; L42-M111 HydrophobicContact CD2-CB 4.01Å; L42-M111 HydrophobicContact CD2-SD 4.44Å; L42-M111 HydrophobicContact CG-CB 3.86Å; L42-M111 HydrophobicContact CG-SD 4.13Å; A43-M111 HydrophobicContact CB-SD 4.23Å; F46-M111 HydrophobicContact CB-CB 4.16Å; F46-M111 HydrophobicContact CB-CG 3.9Å; F46-M111 HydrophobicContact CB-SD 4.15Å; F46-M111 HydrophobicContact CD1-CG 4.36Å; F46-M111 HydrophobicContact CD2-CB 4.2Å; F46-M111 HydrophobicContact CD2-CG 3.88Å; F46-M111 HydrophobicContact CE2-CG 4.5Å; F46-M111 HydrophobicContact CG-CB 4.34Å; F46-M111 HydrophobicContact CG-CG 3.78Å; F46-M111 HydrophobicContact CG-SD 4.39Å; V75-M111 HydrophobicContact CB-CG 4.3Å; V75-M111 HydrophobicContact CG1-CE 4.33Å; V75-M111 HydrophobicContact CG1-CG 3.7Å; V75-M111 HydrophobicContact CG1-SD 4.09Å; V75-M111 HydrophobicContact CG2-CB 4.43Å; V75-M111 HydrophobicContact CG2-CG 3.52Å; P107-M111 HydrophobicContact CB-CE 3.94Å; P107-M111 WeakPolarHBondContact O-CB 3.38Å; P107-M111 WeakPolarHBondContact O-CE 3.48Å; P107-M111 VanDerWaalsContact O-CG 3.31Å; P107-M111 WeakPolarHBondContact O-CG 3.35Å; P107-M111 PolarHBondContact O-N 3.14Å; S108-M111 PolarHBondContact O-N 3.06Å; Q109-M111 PolarHBondContact O-N 3.01Å; M111-E113 PolarHBondContact O-N 2.97Å; M111-Y114 PolarHBondContact O-N 3.24Å; M111-I115 WeakPolarHBondContact O-CD1 3.41Å; M111-I115 WeakPolarHBondContact O-CG1 3.33Å; M111-I115 PolarHBondContact O-N 3.14Å
112	Q	90.8	Very high	86.3	Confident	105 Å²	105	48.8 Å²	48.8	49%	0.491	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-44.3	178.8	-74.7	175.3	-5.9	0	0	112.2	L42 S108 Q109 I115 A116	L42-Q112 HydrophobicContact CD1-CG 3.84Å; L42-Q112 HydrophobicContact CD2-CG 4.06Å; S108-Q112 WeakPolarHBondContact O-CB 3.47Å; S108-Q112 VanDerWaalsContact O-CG 3.29Å; S108-Q112 WeakPolarHBondContact O-CG 3.05Å; S108-Q112 PolarHBondContact O-N 3.08Å; Q109-Q112 PolarHBondContact O-N 3.24Å; Q112-I115 PolarHBondContact O-N 3.38Å; Q112-A116 VanDerWaalsContact O-CB 3.28Å; Q112-A116 WeakPolarHBondContact O-CB 3.45Å; Q112-A116 PolarHBondContact O-N 2.87Å
113	E	90.6	Very high	86.8	Confident	41 Å²	41	52 Å²	52	19%	0.192	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-41.9	177.7	-76	-176.5	-151.1	0	0	112.2	Y67 R71 Q109 M111 A116 V117	Y67-E113 PolarHBondContact OH-OE2 3.36Å; R71-E113 HydrophobicContact CG-CB 4.45Å; R71-E113 IonicContact CZ-OE2 3.03Å; R71-E113 IonicContact NE-OE2 2.75Å; R71-E113 PolarHBondContact NE-OE2 2.59Å; R71-E113 IonicContact NH2-OE1 3.72Å; R71-E113 IonicContact NH2-OE2 2.64Å; R71-E113 PolarHBondContact NH2-OE2 3.38Å; Q109-E113 WeakPolarHBondContact CG-OE1 3.5Å; Q109-E113 PolarHBondContact NE2-OE1 3.36Å; Q109-E113 WeakPolarHBondContact O-CB 3.31Å; Q109-E113 WeakPolarHBondContact O-CG 3.21Å; Q109-E113 PolarHBondContact O-N 3.23Å; M111-E113 PolarHBondContact O-N 2.97Å; E113-A116 PolarHBondContact O-N 3.01Å; E113-V117 WeakPolarHBondContact O-CG2 3.24Å; E113-V117 PolarHBondContact O-N 3.03Å
114	Y	89.8	Confident	87.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-58	-52.4	174.7	-172.8	-81.2	0	0	0	111.1	F46 A49 A50 L53 L68 R71 Y72 A110 M111 A116 V117 V118	F46-Y114 AromaticContact CD2-CD1 3.81Å; F46-Y114 HydrophobicContact CD2-CD1 3.81Å; F46-Y114 AromaticContact CD2-CG 3.91Å; F46-Y114 HydrophobicContact CD2-CG 3.91Å; F46-Y114 AromaticContact CE2-CD1 3.85Å; F46-Y114 HydrophobicContact CE2-CD1 3.85Å; F46-Y114 AromaticContact CE2-CD2 3.97Å; F46-Y114 HydrophobicContact CE2-CD2 3.97Å; F46-Y114 HydrophobicContact CE2-CE1 4.37Å; F46-Y114 HydrophobicContact CE2-CE2 4.47Å; F46-Y114 AromaticContact CE2-CG 3.63Å; F46-Y114 HydrophobicContact CE2-CG 3.63Å; A49-Y114 HydrophobicContact CB-CD1 3.95Å; A49-Y114 HydrophobicContact CB-CE1 3.84Å; A50-Y114 WeakPolarHBondContact CA-OH 3.25Å; A50-Y114 HydrophobicContact CB-CE1 4.18Å; L53-Y114 WeakPolarHBondContact CD2-OH 3.28Å; L68-Y114 HydrophobicContact CB-CD2 4.25Å; L68-Y114 HydrophobicContact CB-CE2 3.84Å; L68-Y114 HydrophobicContact CD2-CD1 4.32Å; L68-Y114 HydrophobicContact CD2-CD2 3.64Å; L68-Y114 HydrophobicContact CD2-CE1 4.38Å; L68-Y114 HydrophobicContact CD2-CE2 3.73Å; L68-Y114 HydrophobicContact CD2-CG 3.95Å; L68-Y114 HydrophobicContact CG-CE2 4.39Å; L68-Y114 VanDerWaalsContact O-CD2 3.26Å; L68-Y114 WeakPolarHBondContact O-CD2 3.38Å; L68-Y114 WeakPolarHBondContact O-CE2 3.33Å; R71-Y114 HydrophobicContact CB-CD2 4.1Å; Y72-Y114 HydrophobicContact CD2-CE2 4.43Å; A110-Y114 WeakPolarHBondContact O-CB 3.2Å; A110-Y114 PolarHBondContact O-N 3.48Å; M111-Y114 PolarHBondContact O-N 3.24Å; Y114-A116 VanDerWaalsContact C-N 3.28Å; Y114-A116 PolarHBondContact O-N 2.67Å; Y114-V117 PolarHBondContact O-N 3.07Å; Y114-V118 HydrophobicContact CD1-CG2 4.03Å; Y114-V118 HydrophobicContact CE1-CG2 3.69Å; Y114-V118 WeakPolarHBondContact O-CG2 3.41Å; Y114-V118 PolarHBondContact O-N 3.09Å
115	I	89.6	Confident	87.6	Confident	13 Å²	13	51.8 Å²	51.8	7%	0.067	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-40.5	178.7	-65.9	161	0	0	0	110.8	L42 L45 F46 A49 M111 Q112 V117 V118 K119	L42-I115 HydrophobicContact CD1-CD1 3.67Å; L45-I115 HydrophobicContact CB-CD1 3.85Å; F46-I115 HydrophobicContact CB-CD1 4.2Å; F46-I115 HydrophobicContact CB-CG1 4.46Å; A49-I115 HydrophobicContact CB-CG1 4.06Å; M111-I115 WeakPolarHBondContact O-CD1 3.41Å; M111-I115 WeakPolarHBondContact O-CG1 3.33Å; M111-I115 PolarHBondContact O-N 3.14Å; Q112-I115 PolarHBondContact O-N 3.38Å; I115-V117 VanDerWaalsContact C-N 3.34Å; I115-V117 PolarHBondContact O-N 2.76Å; I115-V118 PolarHBondContact O-N 3.03Å; I115-K119 HydrophobicContact CG2-CD 4.17Å; I115-K119 HydrophobicContact CG2-CG 4.49Å; I115-K119 WeakPolarHBondContact O-CB 3.48Å; I115-K119 WeakPolarHBondContact O-CG 3.5Å; I115-K119 PolarHBondContact O-N 2.83Å
116	A	90.5	Very high	87.5	Confident	44 Å²	44	54 Å²	54	36%	0.364	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-38.7	179.4	0	0	0	0	0	112.3	Q112 E113 Y114 K120	Q112-A116 VanDerWaalsContact O-CB 3.28Å; Q112-A116 WeakPolarHBondContact O-CB 3.45Å; Q112-A116 PolarHBondContact O-N 2.87Å; E113-A116 PolarHBondContact O-N 3.01Å; Y114-A116 VanDerWaalsContact C-N 3.28Å; Y114-A116 PolarHBondContact O-N 2.67Å; A116-K120 WeakPolarHBondContact O-CG 3.35Å; A116-K120 PolarHBondContact O-N 3.46Å; A116-K120 VanDerWaalsContact O-N 3.1Å
117	V	89.7	Confident	86.7	Confident	20 Å²	20	51.7 Å²	51.7	12%	0.121	29%	0.291	C	S	.	.	H	α-helix	trans	-70.9	-43	176.3	173.8	0	0	0	0	111.4	Y67 L68 E113 Y114 I115 K119 K120 L121	Y67-V117 HydrophobicContact CD1-CG2 3.91Å; Y67-V117 HydrophobicContact CE1-CB 4.44Å; Y67-V117 HydrophobicContact CE1-CG2 3.5Å; Y67-V117 VanDerWaalsContact CE1-CG2 3.5Å; L68-V117 HydrophobicContact CD1-CG1 3.93Å; L68-V117 HydrophobicContact CD2-CB 3.72Å; L68-V117 HydrophobicContact CD2-CG1 3.69Å; L68-V117 HydrophobicContact CG-CB 4.31Å; L68-V117 HydrophobicContact CG-CG1 3.75Å; E113-V117 WeakPolarHBondContact O-CG2 3.24Å; E113-V117 PolarHBondContact O-N 3.03Å; Y114-V117 PolarHBondContact O-N 3.07Å; I115-V117 VanDerWaalsContact C-N 3.34Å; I115-V117 PolarHBondContact O-N 2.76Å; V117-K119 VanDerWaalsContact C-N 3.29Å; V117-K119 PolarHBondContact O-N 3.06Å; V117-K120 WeakPolarHBondContact O-CB 3.49Å; V117-K120 PolarHBondContact O-N 2.91Å; V117-L121 HydrophobicContact CG1-CD1 4.19Å; V117-L121 HydrophobicContact CG1-CG 4.43Å; V117-L121 WeakPolarHBondContact O-CG 3.32Å; V117-L121 PolarHBondContact O-N 3.3Å
118	V	87.9	Confident	85.8	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58	-42.5	174.8	174	0	0	0	0	111.2	A49 H52 L56 L68 Y114 I115 K120 L121 D122 W125	A49-V118 HydrophobicContact CB-CB 4.27Å; A49-V118 HydrophobicContact CB-CG1 4.26Å; A49-V118 HydrophobicContact CB-CG2 4.16Å; H52-V118 HydrophobicContact CB-CG1 4.49Å; L56-V118 HydrophobicContact CD1-CG1 4.06Å; L68-V118 HydrophobicContact CD2-CG2 3.96Å; Y114-V118 HydrophobicContact CD1-CG2 4.03Å; Y114-V118 HydrophobicContact CE1-CG2 3.69Å; Y114-V118 WeakPolarHBondContact O-CG2 3.41Å; Y114-V118 PolarHBondContact O-N 3.09Å; I115-V118 PolarHBondContact O-N 3.03Å; V118-K120 VanDerWaalsContact C-N 3.31Å; V118-K120 PolarHBondContact O-N 3.47Å; V118-L121 PolarHBondContact O-N 2.93Å; V118-D122 PolarHBondContact O-N 3.23Å; V118-W125 HydrophobicContact CG1-CD2 4.4Å; V118-W125 HydrophobicContact CG1-CE3 3.87Å; V118-W125 HydrophobicContact CG1-CZ3 3.98Å
119	K	89.9	Confident	84.3	Confident	102 Å²	102	59.3 Å²	59.3	44%	0.443	32%	0.318	S	S	.	.	H	α-helix	trans	-65.4	-28.4	174.2	-74.6	179	177.2	-179.4	0	114.2	I115 V117 D122 P123 W125	I115-K119 HydrophobicContact CG2-CD 4.17Å; I115-K119 HydrophobicContact CG2-CG 4.49Å; I115-K119 WeakPolarHBondContact O-CB 3.48Å; I115-K119 WeakPolarHBondContact O-CG 3.5Å; I115-K119 PolarHBondContact O-N 2.83Å; V117-K119 VanDerWaalsContact C-N 3.29Å; V117-K119 PolarHBondContact O-N 3.06Å; K119-D122 CarbonylContact O-C 3.44Å; K119-P123 VanDerWaalsContact O-CA 3.27Å; K119-P123 WeakPolarHBondContact O-CA 3.46Å; K119-P123 VanDerWaalsContact O-N 3.17Å; K119-W125 HydrophobicContact CG-CE3 4.13Å; K119-W125 HydrophobicContact CG-CZ3 4.37Å
120	K	89.7	Confident	82.4	Confident	164 Å²	164	61.1 Å²	61.1	71%	0.713	34%	0.336	S	S	*	.	H	α-helix	trans	-74.5	-36.5	174	-77.3	175.9	-179.9	179.2	0	111.6	A116 V117 V118	A116-K120 WeakPolarHBondContact O-CG 3.35Å; A116-K120 PolarHBondContact O-N 3.46Å; A116-K120 VanDerWaalsContact O-N 3.1Å; V117-K120 WeakPolarHBondContact O-CB 3.49Å; V117-K120 PolarHBondContact O-N 2.91Å; V118-K120 VanDerWaalsContact C-N 3.31Å; V118-K120 PolarHBondContact O-N 3.47Å
121	L	87.8	Confident	80.3	Confident	24 Å²	24	68.8 Å²	68.8	13%	0.126	37%	0.372	C	S	.	.	H	α-helix	trans	-69.6	-36.1	176.2	-69.9	172.6	0	0	0	111.8	L53 L56 A60 L68 V117 V118	L53-L121 HydrophobicContact CD1-CD1 4.39Å; L56-L121 HydrophobicContact CD1-CB 3.88Å; L56-L121 HydrophobicContact CD1-CD1 4.49Å; A60-L121 HydrophobicContact CB-CD1 3.88Å; A60-L121 HydrophobicContact CB-CD2 3.83Å; L68-L121 HydrophobicContact CD1-CD1 3.71Å; V117-L121 HydrophobicContact CG1-CD1 4.19Å; V117-L121 HydrophobicContact CG1-CG 4.43Å; V117-L121 WeakPolarHBondContact O-CG 3.32Å; V117-L121 PolarHBondContact O-N 3.3Å; V118-L121 PolarHBondContact O-N 2.93Å
122	D	88.1	Confident	78	Confident	45 Å²	45	78.2 Å²	78.2	24%	0.241	41%	0.412	C	S	.	.			trans	-135.4	92.1	173.3	-176.4	1.8	0	0	0	111.3	H52 L56 V118 K119 G124 W125	H52-D122 IonicContact CD2-OD2 3.93Å; H52-D122 IonicContact CE1-OD2 3.8Å; H52-D122 PolarHBondContact CE1-OD2 3.48Å; H52-D122 IonicContact NE2-OD2 2.89Å; H52-D122 PolarHBondContact NE2-OD2 3.5Å; L56-D122 HydrophobicContact CD1-CB 4.12Å; L56-D122 HydrophobicContact CD2-CB 3.79Å; V118-D122 PolarHBondContact O-N 3.23Å; K119-D122 CarbonylContact O-C 3.44Å; D122-G124 PolarHBondContact O-N 3.29Å; D122-G124 WeakPolarHBondContact OD1-CA 3.37Å; D122-G124 PolarHBondContact OD1-N 3.22Å; D122-W125 HydrophobicContact CB-CB 4.1Å; D122-W125 WeakPolarHBondContact O-CB 3.49Å; D122-W125 PolarHBondContact O-N 3.07Å; D122-W125 PolarHBondContact OD1-N 3.06Å
123	P	87.3	Confident	75.5	Confident	117 Å²	117	81.3 Å²	81.3	76%	0.76	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.6	176.8	-23.6	34.8	0	0	0	114.2	K119	K119-P123 VanDerWaalsContact O-CA 3.27Å; K119-P123 WeakPolarHBondContact O-CA 3.46Å; K119-P123 VanDerWaalsContact O-N 3.17Å
124	G	83.4	Confident	73	Confident	66 Å²	66	82.9 Å²	82.9	68%	0.68	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-10.4	179.2	0	0	0	0	0	113.8	D122 N126	D122-G124 PolarHBondContact O-N 3.29Å; D122-G124 WeakPolarHBondContact OD1-CA 3.37Å; D122-G124 PolarHBondContact OD1-N 3.22Å; G124-N126 PolarHBondContact O-N 3.22Å
125	W	84.1	Confident	70.4	Confident	33 Å²	33	92.5 Å²	92.5	13%	0.125	49%	0.493	C	S	.	.			trans	-69.8	125	-176.7	-179.4	63	0	0	0	112.5	K48 A49 H52 V118 K119 D122 P127	K48-W125 HydrophobicContact CB-CH2 4.38Å; K48-W125 HydrophobicContact CB-CZ2 4Å; K48-W125 WeakPolarHBondContact O-CZ2 3.46Å; A49-W125 HydrophobicContact CB-CH2 3.48Å; A49-W125 VanDerWaalsContact CB-CH2 3.48Å; A49-W125 HydrophobicContact CB-CZ2 4.33Å; A49-W125 HydrophobicContact CB-CZ3 3.9Å; H52-W125 HydrophobicContact CB-CD2 4.42Å; H52-W125 HydrophobicContact CB-CZ2 4.08Å; H52-W125 AromaticContact CD2-CD1 3.35Å; H52-W125 AromaticContact CD2-CD2 3.77Å; H52-W125 AromaticContact CD2-CE2 3.96Å; H52-W125 AromaticContact CD2-CG 3.41Å; H52-W125 VanDerWaalsContact CD2-CG 3.41Å; H52-W125 AromaticContact CD2-NE1 3.67Å; H52-W125 AromaticContact CE1-CD1 3.45Å; H52-W125 VanDerWaalsContact CE1-CD1 3.45Å; H52-W125 AromaticContact CG-CD1 3.42Å; H52-W125 VanDerWaalsContact CG-CD1 3.42Å; H52-W125 AromaticContact CG-CE2 3.82Å; H52-W125 AromaticContact CG-CG 3.91Å; H52-W125 AromaticContact CG-NE1 3.33Å; H52-W125 VanDerWaalsContact CG-NE1 3.33Å; H52-W125 AromaticContact ND1-CD1 3.48Å; H52-W125 AromaticContact ND1-NE1 3.6Å; H52-W125 AromaticContact NE2-CD1 3.37Å; H52-W125 AromaticContact NE2-CG 3.54Å; V118-W125 HydrophobicContact CG1-CD2 4.4Å; V118-W125 HydrophobicContact CG1-CE3 3.87Å; V118-W125 HydrophobicContact CG1-CZ3 3.98Å; K119-W125 HydrophobicContact CG-CE3 4.13Å; K119-W125 HydrophobicContact CG-CZ3 4.37Å; D122-W125 HydrophobicContact CB-CB 4.1Å; D122-W125 WeakPolarHBondContact O-CB 3.49Å; D122-W125 PolarHBondContact O-N 3.07Å; D122-W125 PolarHBondContact OD1-N 3.06Å; W125-P127 HydrophobicContact CH2-CB 3.86Å; W125-P127 HydrophobicContact CH2-CG 4.16Å; W125-P127 HydrophobicContact CZ2-CB 3.75Å; W125-P127 HydrophobicContact CZ2-CG 4.42Å; W125-P127 HydrophobicContact CZ3-CG 4.42Å
126	N	77.7	Confident	68.3	Low	79 Å²	79	99.5 Å²	99.5	42%	0.422	53%	0.526	S	S	.	.			trans	-123.6	109.4	175.8	-173.3	-0.4	0	0	0	111.6	G124 Q128 I129	G124-N126 PolarHBondContact O-N 3.22Å; N126-Q128 PolarHBondContact O-N 2.9Å; N126-Q128 VanDerWaalsContact O-N 3.09Å; N126-Q128 PolarHBondContact OD1-N 2.8Å; N126-Q128 VanDerWaalsContact OD1-N 3.17Å; N126-I129 HydrophobicContact CB-CD1 4.12Å; N126-I129 HydrophobicContact CB-CG1 4.39Å; N126-I129 PolarHBondContact O-N 3.44Å
127	P	70.2	Confident	65.6	Low	18 Å²	18	102 Å²	102	12%	0.117	55%	0.546	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-2.2	-177.4	27.2	-33.6	0	0	0	114.9	L45 K48 W125	L45-P127 HydrophobicContact CD2-CB 3.76Å; L45-P127 HydrophobicContact CD2-CG 3.5Å; L45-P127 VanDerWaalsContact CD2-CG 3.5Å; K48-P127 HydrophobicContact CB-CB 4.28Å; K48-P127 HydrophobicContact CD-CB 3.91Å; K48-P127 WeakPolarHBondContact CD-O 3.48Å; K48-P127 PolarHBondContact NZ-O 3.48Å; W125-P127 HydrophobicContact CH2-CB 3.86Å; W125-P127 HydrophobicContact CH2-CG 4.16Å; W125-P127 HydrophobicContact CZ2-CB 3.75Å; W125-P127 HydrophobicContact CZ2-CG 4.42Å; W125-P127 HydrophobicContact CZ3-CG 4.42Å
128	Q	63.3	Low	62.9	Low	165 Å²	165	108.5 Å²	108.5	77%	0.771	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-3.3	178.3	-63.5	-158.5	-12.5	0	0	114.4	N126	N126-Q128 PolarHBondContact O-N 2.9Å; N126-Q128 VanDerWaalsContact O-N 3.09Å; N126-Q128 PolarHBondContact OD1-N 2.8Å; N126-Q128 VanDerWaalsContact OD1-N 3.17Å
129	I	55.3	Low	60.8	Low	116 Å²	116	115.2 Å²	115.2	60%	0.595	62%	0.621	S	S	*	*	S	Bend	trans	-100.8	120.7	178	-54.7	173.1	0	0	0	108.6	N126 E131	N126-I129 HydrophobicContact CB-CD1 4.12Å; N126-I129 HydrophobicContact CB-CG1 4.39Å; N126-I129 PolarHBondContact O-N 3.44Å; I129-E131 PolarHBondContact O-N 3.36Å
130	P	48.5	Very low	58	Low	117 Å²	117	113.4 Å²	113.4	76%	0.76	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-70.5	117.4	176	26.1	-29.8	0	0	0	109.8
131	E	43.9	Very low	55.2	Low	160 Å²	160	113 Å²	113	75%	0.748	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-64.3	135.4	169.3	-66.1	-173.6	149.8	0	0	109.6	I129 K133	I129-E131 PolarHBondContact O-N 3.36Å; E131-K133 PolarHBondContact O-N 3.31Å
132	K	39.1	Very low	52.7	Low	213 Å²	213	114.3 Å²	114.3	93%	0.926	65%	0.649	S	S	*	*			trans	-61.6	110.6	-178.7	-87.1	-179.2	174.8	174.9	0	110	G134	K132-G134 PolarHBondContact O-N 2.65Å
133	K	39.3	Very low	50.3	Low	171 Å²	171	113.5 Å²	113.5	74%	0.743	65%	0.652	S	S	*	*			trans	-46.7	102.3	168	-88.4	-174.8	168.4	-172.3	0	111.3	E131 E136	E131-K133 PolarHBondContact O-N 3.31Å; K133-E136 IonicContact NZ-OE1 2.67Å; K133-E136 PolarHBondContact NZ-OE1 2.77Å
134	G	37.9	Very low	48.1	Very low	73 Å²	73	112.4 Å²	112.4	75%	0.753	65%	0.645	S	S	*	*			trans	-86.7	100.2	157.6	0	0	0	0	0	109	K132	K132-G134 PolarHBondContact O-N 2.65Å
135	K	35.9	Very low	46.2	Very low	203 Å²	203	110.8 Å²	110.8	88%	0.883	62%	0.621	S	S	*	*	S	Bend	trans	46.5	111.2	170.1	-68.5	-177.2	178.4	179	0	117.1	A137	K135-A137 PolarHBondContact O-N 3.14Å
136	E	45.6	Very low	43.9	Very low	160 Å²	160	110.5 Å²	110.5	75%	0.748	62%	0.622	S	S	*	*			trans	-51.1	116.4	174.5	-61.5	-177.3	149.8	0	0	112.3	K133	K133-E136 IonicContact NZ-OE1 2.67Å; K133-E136 PolarHBondContact NZ-OE1 2.77Å
137	A	33.5	Very low	41.9	Very low	97 Å²	97	108 Å²	108	80%	0.802	61%	0.611	S	S	*	*			trans	-107.7	125	153.3	0	0	0	0	0	107.3	K135	K135-A137 PolarHBondContact O-N 3.14Å
138	N	33.1	Very low	40.4	Very low	155 Å²	155	111.5 Å²	111.5	83%	0.829	64%	0.636	S	S	*	*			trans	-8.4	125.3	171	-154.1	14.1	0	0	0	117.1	G140	N138-G140 PolarHBondContact O-N 2.82Å; N138-G140 VanDerWaalsContact O-N 3.09Å
139	T	42.7	Very low	39.2	Very low	141 Å²	141	106.7 Å²	106.7	87%	0.865	62%	0.615	S	S	*	*			trans	-59.2	106	171.3	44.7	0	0	0	0	111.2
140	G	32.2	Very low	38.5	Very low	65 Å²	65	107 Å²	107	67%	0.67	61%	0.61	S	S	*	*			trans	-163.1	115.3	168.2	0	0	0	0	0	108.3	N138	N138-G140 PolarHBondContact O-N 2.82Å; N138-G140 VanDerWaalsContact O-N 3.09Å
141	F	31.3	Very low	38	Very low	156 Å²	156	104.9 Å²	104.9	68%	0.684	59%	0.589	S	S	*	*	S	Bend	trans	46.4	119.4	166.7	-140.9	-106.4	0	0	0	117.6	G143	F141-G143 PolarHBondContact O-N 3.38Å
142	G	33.5	Very low	37.8	Very low	50 Å²	50	107.1 Å²	107.1	52%	0.515	60%	0.6	S	S	.	*	S	Bend	trans	-43.4	109.3	-175.6	0	0	0	0	0	114.6
143	G	38.1	Very low	37.8	Very low	28 Å²	28	102.3 Å²	102.3	29%	0.289	58%	0.58	S	S	.	*			trans	69	122.5	147.3	0	0	0	0	0	117	F141 V145 I146	F141-G143 PolarHBondContact O-N 3.38Å; G143-V145 PolarHBondContact O-N 3.19Å; G143-I146 PolarHBondContact O-N 2.89Å
144	P	41.5	Very low	37.9	Very low	94 Å²	94	100.6 Å²	100.6	61%	0.61	58%	0.584	S	S	*	*	H	α-helix	trans	-54.4	-12.4	178.4	-26.6	34.2	0	0	0	116.9	S148	P144-S148 PolarHBondContact O-N 3.44Å; P144-S148 PolarHBondContact O-OG 3.46Å
145	V	42.7	Very low	38.3	Very low	32 Å²	32	99.7 Å²	99.7	19%	0.194	56%	0.562	C	S	.	*	H	α-helix	trans	-93.4	-33.5	-171.7	161.7	0	0	0	0	114.6	Q54 I57 G143 S147 S148	Q54-V145 HydrophobicContact CB-CB 3.97Å; Q54-V145 HydrophobicContact CB-CG1 4.25Å; Q54-V145 HydrophobicContact CB-CG2 3.97Å; Q54-V145 HydrophobicContact CG-CB 4.08Å; Q54-V145 HydrophobicContact CG-CG2 3.51Å; Q54-V145 VanDerWaalsContact NE2-CG2 3.3Å; I57-V145 HydrophobicContact CD1-CB 4.2Å; I57-V145 HydrophobicContact CD1-CG1 3.27Å; I57-V145 HydrophobicContact CD1-CG2 3.86Å; I57-V145 HydrophobicContact CG1-CG1 3.9Å; G143-V145 PolarHBondContact O-N 3.19Å; V145-S147 VanDerWaalsContact C-N 3.32Å; V145-S148 PolarHBondContact O-OG 3.3Å
146	I	35.8	Very low	39.1	Very low	27 Å²	27	97.8 Å²	97.8	14%	0.138	55%	0.549	C	S	.	.	H	α-helix	trans	-80.4	-28.9	170.9	-54.7	-106.9	0	0	0	108.8	L53 Y72 G143 S148 L149	L53-I146 HydrophobicContact CD2-CD1 4.05Å; Y72-I146 HydrophobicContact CD1-CG2 4.04Å; Y72-I146 HydrophobicContact CD2-CD1 4.49Å; Y72-I146 HydrophobicContact CE1-CG2 3.76Å; G143-I146 PolarHBondContact O-N 2.89Å; I146-S148 VanDerWaalsContact C-N 3.31Å; I146-S148 PolarHBondContact O-N 3.19Å; I146-L149 PolarHBondContact O-N 3.33Å
147	S	36.5	Very low	39.8	Very low	27 Å²	27	97.4 Å²	97.4	19%	0.189	55%	0.547	C	S	.	.	H	α-helix	trans	-60.4	-32.7	173.8	151.7	0	0	0	0	113.2	V145 L149 Y150 H151	V145-S147 VanDerWaalsContact C-N 3.32Å; S147-L149 PolarHBondContact O-N 3.02Å; S147-L149 VanDerWaalsContact O-N 3.12Å; S147-Y150 CarbonylContact O-C 3.41Å; S147-Y150 PolarHBondContact O-N 2.92Å; S147-H151 PolarHBondContact O-N 3.42Å; S147-H151 PolarHBondContact O-ND1 3.5Å; S147-H151 PolarHBondContact OG-CD2 3.15Å; S147-H151 PolarHBondContact OG-CE1 3.21Å; S147-H151 PolarHBondContact OG-ND1 3.25Å; S147-H151 PolarHBondContact OG-NE2 2.9Å
148	S	39.3	Very low	41.2	Very low	91 Å²	91	98.6 Å²	98.6	64%	0.636	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-22.7	178.2	-19.3	0	0	0	0	113.4	P144 V145 I146	P144-S148 PolarHBondContact O-N 3.44Å; P144-S148 PolarHBondContact O-OG 3.46Å; V145-S148 PolarHBondContact O-OG 3.3Å; I146-S148 VanDerWaalsContact C-N 3.31Å; I146-S148 PolarHBondContact O-N 3.19Å
149	L	38.4	Very low	42.9	Very low	64 Å²	64	96.6 Å²	96.6	34%	0.335	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-17.4	-178.5	-62.8	169.9	0	0	0	113.2	Y69 E91 I146 S147	Y69-L149 HydrophobicContact CD2-CD1 4.21Å; E91-L149 WeakPolarHBondContact OE1-CD2 3.42Å; I146-L149 PolarHBondContact O-N 3.33Å; S147-L149 PolarHBondContact O-N 3.02Å; S147-L149 VanDerWaalsContact O-N 3.12Å
150	Y	39.2	Very low	44.5	Very low	124 Å²	124	91.9 Å²	91.9	49%	0.486	49%	0.493	S	S	.	.	S	Bend	trans	-150.4	57.1	-179	-77.8	-86.2	0	0	0	112.7	Y69 K95 S147	Y69-Y150 HydrophobicContact CD2-CE2 4.46Å; Y69-Y150 HydrophobicContact CE1-CE2 4.38Å; Y69-Y150 AromaticContact CE2-CD2 3.74Å; Y69-Y150 HydrophobicContact CE2-CD2 3.74Å; Y69-Y150 AromaticContact CE2-CE2 3.31Å; Y69-Y150 HydrophobicContact CE2-CE2 3.31Å; Y69-Y150 AromaticContact CZ-CE2 3.27Å; Y69-Y150 AromaticContact CZ-CZ 3.89Å; Y69-Y150 WeakPolarHBondContact OH-CE2 3.44Å; Y69-Y150 PolarHBondContact OH-OH 2.87Å; K95-Y150 HydrophobicContact CD-CE2 4.39Å; S147-Y150 CarbonylContact O-C 3.41Å; S147-Y150 PolarHBondContact O-N 2.92Å
151	H	38.8	Very low	47.1	Very low	72 Å²	72	92.4 Å²	92.4	33%	0.333	48%	0.481	S	S	.	.			trans	-106.6	90.7	161.7	-87.7	25.5	0	0	0	110.5	S147 E153	S147-H151 PolarHBondContact O-N 3.42Å; S147-H151 PolarHBondContact O-ND1 3.5Å; S147-H151 PolarHBondContact OG-CD2 3.15Å; S147-H151 PolarHBondContact OG-CE1 3.21Å; S147-H151 PolarHBondContact OG-ND1 3.25Å; S147-H151 PolarHBondContact OG-NE2 2.9Å; H151-E153 HydrophobicContact CB-CB 3.95Å; H151-E153 WeakPolarHBondContact CD2-CB 3.24Å; H151-E153 IonicContact CD2-OE2 3.03Å; H151-E153 IonicContact CE1-OE2 2.72Å; H151-E153 PolarHBondContact CE1-OE2 3.03Å; H151-E153 WeakPolarHBondContact NE2-CB 3.36Å; H151-E153 IonicContact NE2-OE2 2.77Å; H151-E153 PolarHBondContact NE2-OE2 3.35Å; H151-E153 PolarHBondContact O-N 2.86Å
152	E	38.7	Very low	49.9	Very low	207 Å²	207	86 Å²	86	97%	0.967	45%	0.454	S	S	*	.				-78.5	40	126.9	-77.7	-175.3	162.9	0	0	109.3
153	E	39.2	Very low	52.6	Low	111 Å²	111	84.4 Å²	84.4	52%	0.519	43%	0.432	S	S	.	.	S	Bend	trans	-105.3	118.9	166.7	-115.4	175.3	-138.7	0	0	105.2	H151 I155	H151-E153 HydrophobicContact CB-CB 3.95Å; H151-E153 WeakPolarHBondContact CD2-CB 3.24Å; H151-E153 IonicContact CD2-OE2 3.03Å; H151-E153 IonicContact CE1-OE2 2.72Å; H151-E153 PolarHBondContact CE1-OE2 3.03Å; H151-E153 WeakPolarHBondContact NE2-CB 3.36Å; H151-E153 IonicContact NE2-OE2 2.77Å; H151-E153 PolarHBondContact NE2-OE2 3.35Å; H151-E153 PolarHBondContact O-N 2.86Å; E153-I155 PolarHBondContact O-N 3.39Å
154	T	41.8	Very low	54.9	Low	135 Å²	135	83.6 Å²	83.6	83%	0.828	42%	0.421	S	S	*	.			trans	-44.7	90.5	-173.9	-39.5	0	0	0	0	111.5	R156	T154-R156 PolarHBondContact O-N 2.77Å; T154-R156 VanDerWaalsContact O-N 3.08Å
155	I	47	Very low	57.1	Low	55 Å²	55	80.5 Å²	80.5	28%	0.282	40%	0.398	S	S	.	.			trans	-53.4	122.1	165.4	-57.5	173	0	0	0	104.9	E153 E157 D159 K160 D164	E153-I155 PolarHBondContact O-N 3.39Å; I155-E157 PolarHBondContact O-N 2.67Å; I155-D159 HydrophobicContact CG2-CB 3.97Å; I155-K160 HydrophobicContact CB-CG 3.93Å; I155-K160 HydrophobicContact CG2-CB 4.49Å; I155-K160 HydrophobicContact CG2-CG 3.63Å; I155-K160 VanDerWaalsContact O-CE 3.29Å; I155-K160 WeakPolarHBondContact O-CE 3.43Å; I155-D164 HydrophobicContact CD1-CB 4.34Å
156	R	51.4	Low	59.4	Low	163 Å²	163	79 Å²	79	62%	0.615	39%	0.388	S	S	*	.			trans	-55.3	136.7	176.8	-63.5	176.4	63.9	154	-0.9	107.3	T154 E158 D159 K160	T154-R156 PolarHBondContact O-N 2.77Å; T154-R156 VanDerWaalsContact O-N 3.08Å; R156-E158 HydrophobicContact CB-CG 4.01Å; R156-E158 IonicContact CZ-OE1 3.98Å; R156-E158 IonicContact NE-OE1 2.67Å; R156-E158 PolarHBondContact NE-OE1 3.16Å; R156-E158 IonicContact NH2-OE1 2.8Å; R156-E158 PolarHBondContact NH2-OE1 2.99Å; R156-E158 PolarHBondContact O-N 2.99Å; R156-D159 PolarHBondContact O-N 3.33Å; R156-K160 PolarHBondContact O-N 2.93Å
157	E	60.2	Low	61.7	Low	151 Å²	151	80.9 Å²	80.9	71%	0.706	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-54.9	-29.5	-172.8	-68.8	-175.3	167	0	0	112.7	I155 D159	I155-E157 PolarHBondContact O-N 2.67Å; E157-D159 VanDerWaalsContact C-N 3.31Å; E157-D159 PolarHBondContact O-N 3.43Å
158	E	63.5	Low	64.1	Low	123 Å²	123	84.3 Å²	84.3	58%	0.575	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-65.7	-24.5	175.1	57.7	-107.6	-139.4	0	0	115.7	R156	R156-E158 HydrophobicContact CB-CG 4.01Å; R156-E158 IonicContact CZ-OE1 3.98Å; R156-E158 IonicContact NE-OE1 2.67Å; R156-E158 PolarHBondContact NE-OE1 3.16Å; R156-E158 IonicContact NH2-OE1 2.8Å; R156-E158 PolarHBondContact NH2-OE1 2.99Å; R156-E158 PolarHBondContact O-N 2.99Å
159	D	69.3	Low	66.5	Low	112 Å²	112	82.7 Å²	82.7	60%	0.599	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-101	-4.6	-176	-61.8	-42.1	0	0	0	112.4	I155 R156 E157 N161	I155-D159 HydrophobicContact CG2-CB 3.97Å; R156-D159 PolarHBondContact O-N 3.33Å; E157-D159 VanDerWaalsContact C-N 3.31Å; E157-D159 PolarHBondContact O-N 3.43Å; D159-N161 PolarHBondContact O-N 3.26Å
160	K	76.1	Confident	69	Low	42 Å²	42	82.4 Å²	82.4	18%	0.183	39%	0.39	C	S	.	.			trans	-69	124.7	179.6	-73	-172.9	179.2	-175.3	0	111.1	I155 R156 D164 Y165 E168	I155-K160 HydrophobicContact CB-CG 3.93Å; I155-K160 HydrophobicContact CG2-CB 4.49Å; I155-K160 HydrophobicContact CG2-CG 3.63Å; I155-K160 VanDerWaalsContact O-CE 3.29Å; I155-K160 WeakPolarHBondContact O-CE 3.43Å; R156-K160 PolarHBondContact O-N 2.93Å; K160-D164 WeakPolarHBondContact CA-OD2 3.4Å; K160-D164 HydrophobicContact CB-CB 4.1Å; K160-D164 HydrophobicContact CD-CB 4.42Å; K160-D164 HydrophobicContact CG-CB 4.1Å; K160-Y165 HydrophobicContact CB-CD2 4.3Å; K160-Y165 HydrophobicContact CB-CE2 3.6Å; K160-Y165 HydrophobicContact CD-CE1 4.05Å; K160-Y165 HydrophobicContact CD-CE2 4.48Å; K160-E168 VanDerWaalsContact CE-OE1 3.22Å; K160-E168 WeakPolarHBondContact CE-OE1 3.24Å; K160-E168 IonicContact NZ-OE1 3.47Å; K160-E168 PolarHBondContact NZ-OE1 3.03Å; K160-E168 IonicContact NZ-OE2 2.68Å; K160-E168 PolarHBondContact NZ-OE2 3.25Å
161	N	86.8	Confident	71.7	Confident	77 Å²	77	78.5 Å²	78.5	41%	0.412	38%	0.377	S	S	.	.			trans	-87	175.1	167.2	69.3	52.5	0	0	0	110.8	D159 F163 D164 Y165	D159-N161 PolarHBondContact O-N 3.26Å; N161-F163 PolarHBondContact O-N 3.23Å; N161-F163 WeakPolarHBondContact OD1-CA 3.34Å; N161-F163 VanDerWaalsContact OD1-CB 3.28Å; N161-F163 WeakPolarHBondContact OD1-CB 3.28Å; N161-F163 PolarHBondContact OD1-N 3.45Å; N161-D164 VanDerWaalsContact CG-OD2 3.22Å; N161-D164 PolarHBondContact N-OD2 3.02Å; N161-D164 PolarHBondContact ND2-OD2 3.18Å; N161-D164 WeakPolarHBondContact O-CB 3.32Å; N161-D164 PolarHBondContact O-N 3.03Å; N161-D164 PolarHBondContact OD1-N 3.31Å; N161-D164 VanDerWaalsContact OD1-N 3.14Å; N161-D164 PolarHBondContact OD1-OD2 3.34Å; N161-Y165 WeakPolarHBondContact O-CD2 3.46Å
162	I	91.1	Very high	74.3	Confident	22 Å²	22	81.6 Å²	81.6	11%	0.113	40%	0.396	C	S	.	.	H	α-helix	trans	-61.2	-31.1	-177.7	-165.8	71.3	0	0	0	113.5	Y165 C166 I174 A177 V183 V187 L195	I162-Y165 PolarHBondContact O-N 3.22Å; I162-C166 PolarHBondContact O-N 2.72Å; I162-C166 VanDerWaalsContact O-N 3.08Å; I162-I174 HydrophobicContact CD1-CD1 3.59Å; I162-I174 HydrophobicContact CG1-CD1 3.7Å; I162-I174 VanDerWaalsContact O-CD1 3.29Å; I162-I174 WeakPolarHBondContact O-CD1 3.37Å; I162-A177 HydrophobicContact CD1-CB 3.61Å; I162-V183 HydrophobicContact CB-CG1 4.42Å; I162-V183 HydrophobicContact CD1-CG2 4.26Å; I162-V183 HydrophobicContact CG1-CG1 4.03Å; I162-V183 HydrophobicContact CG1-CG2 4.42Å; I162-V183 HydrophobicContact CG2-CG1 4.26Å; I162-V187 HydrophobicContact CG2-CG1 3.98Å; I162-L195 HydrophobicContact CG1-CD1 4.28Å; I162-L195 HydrophobicContact CG1-CD2 4.11Å; I162-L195 HydrophobicContact CG2-CD2 4.29Å
163	F	89.3	Confident	76.9	Confident	15 Å²	15	75.1 Å²	75.1	7%	0.066	37%	0.366	C	S	.	.	H	α-helix	trans	-72.8	-30.3	179.4	-58.3	-78.1	0	0	0	112	N161 C166 R167 V187 D189 R193 L195 W198	N161-F163 PolarHBondContact O-N 3.23Å; N161-F163 WeakPolarHBondContact OD1-CA 3.34Å; N161-F163 VanDerWaalsContact OD1-CB 3.28Å; N161-F163 WeakPolarHBondContact OD1-CB 3.28Å; N161-F163 PolarHBondContact OD1-N 3.45Å; F163-C166 WeakPolarHBondContact O-CB 3.49Å; F163-C166 PolarHBondContact O-N 2.9Å; F163-C166 VanDerWaalsContact O-N 3.15Å; F163-R167 WeakPolarHBondContact O-CG 3.37Å; F163-R167 PolarHBondContact O-N 3.35Å; F163-V187 HydrophobicContact CE1-CG1 4.28Å; F163-V187 HydrophobicContact CE2-CG2 4.35Å; F163-V187 HydrophobicContact CZ-CB 4.42Å; F163-V187 HydrophobicContact CZ-CG1 3.83Å; F163-V187 HydrophobicContact CZ-CG2 4.08Å; F163-D189 HydrophobicContact CD2-CB 4.17Å; F163-D189 HydrophobicContact CE1-CB 4.33Å; F163-D189 HydrophobicContact CE2-CB 3.91Å; F163-D189 HydrophobicContact CG-CB 4.5Å; F163-D189 HydrophobicContact CZ-CB 4Å; F163-D189 VanDerWaalsContact CZ-N 3.3Å; F163-R193 WeakPolarHBondContact CE1-O 3.23Å; F163-L195 HydrophobicContact CD1-CD2 3.68Å; F163-L195 HydrophobicContact CE1-CD2 3.85Å; F163-L195 HydrophobicContact CE1-CG 4.28Å; F163-L195 HydrophobicContact CG-CD2 4.46Å; F163-W198 AromaticContact CD1-CD1 3.55Å; F163-W198 AromaticContact CD1-NE1 3.65Å
164	D	85.6	Confident	79.5	Confident	11 Å²	11	69.8 Å²	69.8	6%	0.059	34%	0.341	C	S	.	.	H	α-helix	trans	-61.9	-47.8	173.6	-55.9	-42.9	0	0	0	110.4	I155 K160 N161 C166 R167 E168	I155-D164 HydrophobicContact CD1-CB 4.34Å; K160-D164 WeakPolarHBondContact CA-OD2 3.4Å; K160-D164 HydrophobicContact CB-CB 4.1Å; K160-D164 HydrophobicContact CD-CB 4.42Å; K160-D164 HydrophobicContact CG-CB 4.1Å; N161-D164 VanDerWaalsContact CG-OD2 3.22Å; N161-D164 PolarHBondContact N-OD2 3.02Å; N161-D164 PolarHBondContact ND2-OD2 3.18Å; N161-D164 WeakPolarHBondContact O-CB 3.32Å; N161-D164 PolarHBondContact O-N 3.03Å; N161-D164 PolarHBondContact OD1-N 3.31Å; N161-D164 VanDerWaalsContact OD1-N 3.14Å; N161-D164 PolarHBondContact OD1-OD2 3.34Å; D164-C166 PolarHBondContact O-N 3.08Å; D164-R167 PolarHBondContact O-N 3.02Å; D164-R167 IonicContact OD1-CZ 3.6Å; D164-R167 IonicContact OD1-NH1 2.82Å; D164-R167 PolarHBondContact OD1-NH1 2.81Å; D164-E168 WeakPolarHBondContact O-CG 3.2Å; D164-E168 PolarHBondContact O-N 3.45Å
165	Y	89.1	Confident	82.1	Confident	30 Å²	30	64.3 Å²	64.3	12%	0.118	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-32.5	173.4	-66.8	-71.1	0	0	0	113	K160 N161 I162 N169 N170 H173	K160-Y165 HydrophobicContact CB-CD2 4.3Å; K160-Y165 HydrophobicContact CB-CE2 3.6Å; K160-Y165 HydrophobicContact CD-CE1 4.05Å; K160-Y165 HydrophobicContact CD-CE2 4.48Å; N161-Y165 WeakPolarHBondContact O-CD2 3.46Å; I162-Y165 PolarHBondContact O-N 3.22Å; Y165-N169 PolarHBondContact O-N 3.01Å; Y165-N170 HydrophobicContact CD1-CB 4.08Å; Y165-N170 PolarHBondContact O-N 3.34Å; Y165-H173 HydrophobicContact CD1-CB 3.98Å; Y165-H173 AromaticContact CD1-CG 3.77Å; Y165-H173 AromaticContact CD1-ND1 3.82Å; Y165-H173 AromaticContact CD2-CE1 3.43Å; Y165-H173 VanDerWaalsContact CD2-CE1 3.43Å; Y165-H173 WeakPolarHBondContact CD2-CE1 3.34Å; Y165-H173 AromaticContact CD2-ND1 3.27Å; Y165-H173 VanDerWaalsContact CD2-ND1 3.27Å; Y165-H173 WeakPolarHBondContact CD2-ND1 3.1Å; Y165-H173 HydrophobicContact CE1-CB 4.45Å; Y165-H173 AromaticContact CE1-CG 3.94Å; Y165-H173 AromaticContact CE2-CE1 3.3Å; Y165-H173 WeakPolarHBondContact CE2-CE1 3.38Å; Y165-H173 AromaticContact CE2-ND1 3.59Å; Y165-H173 AromaticContact CE2-NE2 3.82Å; Y165-H173 HydrophobicContact CG-CB 4.2Å; Y165-H173 AromaticContact CG-CE1 3.99Å; Y165-H173 AromaticContact CG-CG 3.82Å; Y165-H173 AromaticContact CG-ND1 3.38Å; Y165-H173 AromaticContact CZ-CE1 3.75Å; Y165-H173 AromaticContact CZ-ND1 3.99Å; Y165-H173 AromaticContact CZ-NE2 3.83Å
166	C	90.2	Very high	84.4	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67.8	-45.1	176.2	-168.3	0	0	0	0	111.2	I162 F163 D164 E168 N169 I174 L195 H204	I162-C166 PolarHBondContact O-N 2.72Å; I162-C166 VanDerWaalsContact O-N 3.08Å; F163-C166 WeakPolarHBondContact O-CB 3.49Å; F163-C166 PolarHBondContact O-N 2.9Å; F163-C166 VanDerWaalsContact O-N 3.15Å; D164-C166 PolarHBondContact O-N 3.08Å; C166-E168 VanDerWaalsContact C-N 3.3Å; C166-E168 PolarHBondContact O-N 3.36Å; C166-N169 PolarHBondContact O-N 3.02Å; C166-I174 HydrophobicContact CB-CD1 3.95Å; C166-L195 HydrophobicContact CB-CD2 3.73Å; C166-L195 PolarHBondContact SG-O 3.47Å; C166-L195 VanDerWaalsContact SG-O 3.42Å; C166-H204 PolarHBondContact O-CD2 3.08Å
167	R	85.4	Confident	86.4	Confident	66 Å²	66	62 Å²	62	25%	0.249	30%	0.302	C	S	.	.	H	α-helix	trans	-64.2	-36.8	178.3	-69.6	-175.4	-143	105.5	0.8	111.7	F163 D164 N169 W198 H204	F163-R167 WeakPolarHBondContact O-CG 3.37Å; F163-R167 PolarHBondContact O-N 3.35Å; D164-R167 PolarHBondContact O-N 3.02Å; D164-R167 IonicContact OD1-CZ 3.6Å; D164-R167 IonicContact OD1-NH1 2.82Å; D164-R167 PolarHBondContact OD1-NH1 2.81Å; R167-N169 PolarHBondContact O-N 2.73Å; R167-W198 HydrophobicContact CG-CD2 4.16Å; R167-W198 HydrophobicContact CG-CE3 3.64Å; R167-W198 HydrophobicContact CG-CZ3 3.98Å; R167-H204 PolarHBondContact O-NE2 3.48Å
168	E	85	Confident	87.9	Confident	99 Å²	99	55.6 Å²	55.6	46%	0.463	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-0.2	177.4	-69	174	-173.6	0	0	114.4	K160 D164 C166 N170	K160-E168 VanDerWaalsContact CE-OE1 3.22Å; K160-E168 WeakPolarHBondContact CE-OE1 3.24Å; K160-E168 IonicContact NZ-OE1 3.47Å; K160-E168 PolarHBondContact NZ-OE1 3.03Å; K160-E168 IonicContact NZ-OE2 2.68Å; K160-E168 PolarHBondContact NZ-OE2 3.25Å; D164-E168 WeakPolarHBondContact O-CG 3.2Å; D164-E168 PolarHBondContact O-N 3.45Å; C166-E168 VanDerWaalsContact C-N 3.3Å; C166-E168 PolarHBondContact O-N 3.36Å; E168-N170 VanDerWaalsContact C-N 3.25Å; E168-N170 PolarHBondContact O-N 3.14Å
169	N	90.7	Very high	89.3	Confident	57 Å²	57	56.4 Å²	56.4	31%	0.305	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	32.2	-174	-156.8	17.3	0	0	0	113.9	Y165 C166 R167 I171 H204	Y165-N169 PolarHBondContact O-N 3.01Å; C166-N169 PolarHBondContact O-N 3.02Å; R167-N169 PolarHBondContact O-N 2.73Å; N169-I171 VanDerWaalsContact C-N 3.27Å; N169-I171 PolarHBondContact O-N 3.04Å; N169-H204 WeakPolarHBondContact OD1-CB 3.23Å
170	N	91.7	Very high	90.4	Very high	58 Å²	58	53.9 Å²	53.9	31%	0.31	27%	0.265	S	S	.	.			trans	-81	75.8	178.4	-167.8	-29.2	0	0	0	110.8	Y165 E168 D172 H173 I174	Y165-N170 HydrophobicContact CD1-CB 4.08Å; Y165-N170 PolarHBondContact O-N 3.34Å; E168-N170 VanDerWaalsContact C-N 3.25Å; E168-N170 PolarHBondContact O-N 3.14Å; N170-D172 VanDerWaalsContact C-N 3.27Å; N170-D172 PolarHBondContact O-N 2.95Å; N170-H173 HydrophobicContact CB-CB 4.32Å; N170-H173 PolarHBondContact O-N 3.15Å; N170-H173 VanDerWaalsContact OD1-CB 3.29Å; N170-H173 WeakPolarHBondContact OD1-CB 3.49Å; N170-H173 PolarHBondContact OD1-N 3.37Å; N170-I174 WeakPolarHBondContact O-CG1 3.49Å; N170-I174 PolarHBondContact O-N 3.41Å; N170-I174 VanDerWaalsContact O-N 3.11Å
171	I	94	Very high	90.8	Very high	43 Å²	43	61 Å²	61	22%	0.221	30%	0.296	C	S	.	.	H	α-helix	trans	-57.6	-39.6	-176.2	-61.3	175.4	0	0	0	111.5	N169 I174 T175 E206 L207 V210	N169-I171 VanDerWaalsContact C-N 3.27Å; N169-I171 PolarHBondContact O-N 3.04Å; I171-I174 PolarHBondContact O-N 3.32Å; I171-T175 WeakPolarHBondContact O-CB 3.39Å; I171-T175 PolarHBondContact O-N 3Å; I171-T175 PolarHBondContact O-OG1 2.77Å; I171-E206 HydrophobicContact CD1-CB 3.64Å; I171-L207 HydrophobicContact CD1-CB 4.43Å; I171-L207 HydrophobicContact CG1-CB 4.09Å; I171-L207 HydrophobicContact CG1-CD1 4.14Å; I171-V210 HydrophobicContact CG2-CB 4.47Å; I171-V210 HydrophobicContact CG2-CG1 4.41Å; I171-V210 HydrophobicContact CG2-CG2 3.9Å
172	D	94.1	Very high	90.7	Very high	136 Å²	136	63.8 Å²	63.8	73%	0.727	31%	0.311	S	S	*	.	H	α-helix	trans	-63.4	-45.7	-178.3	-74.1	-29.3	0	0	0	111.7	N170 K176	N170-D172 VanDerWaalsContact C-N 3.27Å; N170-D172 PolarHBondContact O-N 2.95Å; D172-K176 VanDerWaalsContact O-CB 3.23Å; D172-K176 WeakPolarHBondContact O-CB 3.01Å; D172-K176 PolarHBondContact O-N 2.82Å
173	H	93.5	Very high	90.6	Very high	71 Å²	71	64.4 Å²	64.4	33%	0.329	32%	0.315	S	S	.	.	H	α-helix	trans	-65.6	-47.5	178.4	-168.7	-87.7	0	0	0	111.4	Y165 N170 T175 K176 A177	Y165-H173 HydrophobicContact CD1-CB 3.98Å; Y165-H173 AromaticContact CD1-CG 3.77Å; Y165-H173 AromaticContact CD1-ND1 3.82Å; Y165-H173 AromaticContact CD2-CE1 3.43Å; Y165-H173 VanDerWaalsContact CD2-CE1 3.43Å; Y165-H173 WeakPolarHBondContact CD2-CE1 3.34Å; Y165-H173 AromaticContact CD2-ND1 3.27Å; Y165-H173 VanDerWaalsContact CD2-ND1 3.27Å; Y165-H173 WeakPolarHBondContact CD2-ND1 3.1Å; Y165-H173 HydrophobicContact CE1-CB 4.45Å; Y165-H173 AromaticContact CE1-CG 3.94Å; Y165-H173 AromaticContact CE2-CE1 3.3Å; Y165-H173 WeakPolarHBondContact CE2-CE1 3.38Å; Y165-H173 AromaticContact CE2-ND1 3.59Å; Y165-H173 AromaticContact CE2-NE2 3.82Å; Y165-H173 HydrophobicContact CG-CB 4.2Å; Y165-H173 AromaticContact CG-CE1 3.99Å; Y165-H173 AromaticContact CG-CG 3.82Å; Y165-H173 AromaticContact CG-ND1 3.38Å; Y165-H173 AromaticContact CZ-CE1 3.75Å; Y165-H173 AromaticContact CZ-ND1 3.99Å; Y165-H173 AromaticContact CZ-NE2 3.83Å; N170-H173 HydrophobicContact CB-CB 4.32Å; N170-H173 PolarHBondContact O-N 3.15Å; N170-H173 VanDerWaalsContact OD1-CB 3.29Å; N170-H173 WeakPolarHBondContact OD1-CB 3.49Å; N170-H173 PolarHBondContact OD1-N 3.37Å; H173-T175 PolarHBondContact O-N 3.08Å; H173-K176 PolarHBondContact O-N 2.67Å; H173-A177 WeakPolarHBondContact O-CB 3.28Å; H173-A177 PolarHBondContact O-N 2.8Å
174	I	94.8	Very high	90.9	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-57.5	-50.2	177.2	-64	-69.7	0	0	0	110.7	I162 C166 N170 I171 K176 A177 I178 L195 L207 L211	I162-I174 HydrophobicContact CD1-CD1 3.59Å; I162-I174 HydrophobicContact CG1-CD1 3.7Å; I162-I174 VanDerWaalsContact O-CD1 3.29Å; I162-I174 WeakPolarHBondContact O-CD1 3.37Å; C166-I174 HydrophobicContact CB-CD1 3.95Å; N170-I174 WeakPolarHBondContact O-CG1 3.49Å; N170-I174 PolarHBondContact O-N 3.41Å; N170-I174 VanDerWaalsContact O-N 3.11Å; I171-I174 PolarHBondContact O-N 3.32Å; I174-K176 VanDerWaalsContact C-N 3.33Å; I174-K176 PolarHBondContact O-N 3.37Å; I174-A177 PolarHBondContact O-N 3.46Å; I174-I178 HydrophobicContact CG2-CD1 3.61Å; I174-I178 HydrophobicContact CG2-CG1 4.46Å; I174-I178 WeakPolarHBondContact O-CG1 3.4Å; I174-I178 PolarHBondContact O-N 3.34Å; I174-L195 HydrophobicContact CD1-CD2 4.3Å; I174-L195 HydrophobicContact CG2-CD1 4.44Å; I174-L207 HydrophobicContact CB-CD1 4.23Å; I174-L207 HydrophobicContact CG1-CD1 4.31Å; I174-L207 HydrophobicContact CG2-CD1 4Å; I174-L211 HydrophobicContact CG2-CD2 3.98Å
175	T	95	Very high	91.3	Very high	20 Å²	20	68.8 Å²	68.8	12%	0.123	34%	0.34	C	S	.	.	H	α-helix	trans	-61.4	-42.4	-179	-58.5	0	0	0	0	111.4	I171 H173 K179 V210	I171-T175 WeakPolarHBondContact O-CB 3.39Å; I171-T175 PolarHBondContact O-N 3Å; I171-T175 PolarHBondContact O-OG1 2.77Å; H173-T175 PolarHBondContact O-N 3.08Å; T175-K179 HydrophobicContact CG2-CD 3.86Å; T175-K179 VanDerWaalsContact CG2-CE 3.46Å; T175-K179 HydrophobicContact CG2-CG 4.39Å; T175-K179 VanDerWaalsContact O-CB 3.3Å; T175-K179 WeakPolarHBondContact O-CB 3.26Å; T175-K179 VanDerWaalsContact O-CG 3.28Å; T175-K179 WeakPolarHBondContact O-CG 3.4Å; T175-K179 PolarHBondContact O-N 3.36Å; T175-V210 WeakPolarHBondContact OG1-CG1 3.5Å
176	K	94.8	Very high	91.7	Very high	156 Å²	156	69.9 Å²	69.9	68%	0.678	35%	0.348	S	S	*	.	H	α-helix	trans	-66.3	-42.2	178.1	-173.1	179.1	178.8	-175.6	0	111.5	D172 H173 I174 K179 S180	D172-K176 VanDerWaalsContact O-CB 3.23Å; D172-K176 WeakPolarHBondContact O-CB 3.01Å; D172-K176 PolarHBondContact O-N 2.82Å; H173-K176 PolarHBondContact O-N 2.67Å; I174-K176 VanDerWaalsContact C-N 3.33Å; I174-K176 PolarHBondContact O-N 3.37Å; K176-K179 PolarHBondContact O-N 2.89Å; K176-S180 WeakPolarHBondContact O-CB 3.09Å; K176-S180 PolarHBondContact O-N 3.32Å; K176-S180 PolarHBondContact O-OG 3.29Å
177	A	93.3	Very high	92	Very high	12 Å²	12	71.9 Å²	71.9	10%	0.099	36%	0.36	C	S	.	.	H	α-helix	trans	-63	-43.8	177.6	0	0	0	0	0	112	I162 H173 I174 S180 N182 V183	I162-A177 HydrophobicContact CD1-CB 3.61Å; H173-A177 WeakPolarHBondContact O-CB 3.28Å; H173-A177 PolarHBondContact O-N 2.8Å; I174-A177 PolarHBondContact O-N 3.46Å; A177-S180 PolarHBondContact O-OG 3.45Å; A177-N182 PolarHBondContact O-N 3.02Å; A177-V183 HydrophobicContact CB-CB 4.37Å; A177-V183 HydrophobicContact CB-CG2 4.07Å; A177-V183 PolarHBondContact O-N 3.48Å
178	I	93.4	Very high	92.4	Very high	17 Å²	17	73.4 Å²	73.4	9%	0.087	37%	0.369	C	S	.	.	H	α-helix	trans	-66.9	-46.9	176.7	-65.4	165.6	0	0	0	110.9	I174 S180 K181 V185 L195 L211 H214	I174-I178 HydrophobicContact CG2-CD1 3.61Å; I174-I178 HydrophobicContact CG2-CG1 4.46Å; I174-I178 WeakPolarHBondContact O-CG1 3.4Å; I174-I178 PolarHBondContact O-N 3.34Å; I178-S180 VanDerWaalsContact C-N 3.32Å; I178-S180 PolarHBondContact O-N 2.93Å; I178-K181 PolarHBondContact O-N 2.87Å; I178-V185 HydrophobicContact CD1-CB 4.26Å; I178-V185 HydrophobicContact CD1-CG2 3.96Å; I178-V185 HydrophobicContact CG1-CB 4.47Å; I178-V185 HydrophobicContact CG2-CB 4.31Å; I178-L195 HydrophobicContact CD1-CD1 4.43Å; I178-L211 HydrophobicContact CD1-CD2 3.81Å; I178-H214 HydrophobicContact CG2-CB 4.01Å
179	K	92.7	Very high	92.5	Very high	141 Å²	141	70 Å²	70	61%	0.613	35%	0.353	S	S	*	.	H	α-helix	trans	-64.2	-35.3	-179.2	-77.8	177.6	-177.8	169.7	0	113.3	T175 K176 K181	T175-K179 HydrophobicContact CG2-CD 3.86Å; T175-K179 VanDerWaalsContact CG2-CE 3.46Å; T175-K179 HydrophobicContact CG2-CG 4.39Å; T175-K179 VanDerWaalsContact O-CB 3.3Å; T175-K179 WeakPolarHBondContact O-CB 3.26Å; T175-K179 VanDerWaalsContact O-CG 3.28Å; T175-K179 WeakPolarHBondContact O-CG 3.4Å; T175-K179 PolarHBondContact O-N 3.36Å; K176-K179 PolarHBondContact O-N 2.89Å; K179-K181 PolarHBondContact O-N 3.24Å
180	S	92.5	Very high	92.1	Very high	58 Å²	58	75 Å²	75	41%	0.406	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-4.7	175.1	53.5	0	0	0	0	113.2	K176 A177 I178 N182	K176-S180 WeakPolarHBondContact O-CB 3.09Å; K176-S180 PolarHBondContact O-N 3.32Å; K176-S180 PolarHBondContact O-OG 3.29Å; A177-S180 PolarHBondContact O-OG 3.45Å; I178-S180 VanDerWaalsContact C-N 3.32Å; I178-S180 PolarHBondContact O-N 2.93Å; S180-N182 PolarHBondContact O-N 3.37Å; S180-N182 PolarHBondContact OG-ND2 2.94Å
181	K	83.4	Confident	91.6	Very high	191 Å²	191	76.5 Å²	76.5	83%	0.83	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	20.6	-173.9	-55.9	-177.5	178.1	-178.2	0	113.4	I178 K179 V183	I178-K181 PolarHBondContact O-N 2.87Å; K179-K181 PolarHBondContact O-N 3.24Å; K181-V183 VanDerWaalsContact C-N 3.28Å
182	N	84.3	Confident	91.4	Very high	136 Å²	136	74.6 Å²	74.6	73%	0.727	37%	0.371	S	S	*	.	S	Bend	trans	-75.8	-25	173.8	-72.1	-11.5	0	0	0	111.2	A177 S180	A177-N182 PolarHBondContact O-N 3.02Å; S180-N182 PolarHBondContact O-N 3.37Å; S180-N182 PolarHBondContact OG-ND2 2.94Å
183	V	90.3	Very high	91.4	Very high	35 Å²	35	69.2 Å²	69.2	21%	0.212	34%	0.34	C	S	.	.	S	Bend	trans	-134	133.3	-179.9	-177.9	0	0	0	0	109.6	I162 A177 K181 V187	I162-V183 HydrophobicContact CB-CG1 4.42Å; I162-V183 HydrophobicContact CD1-CG2 4.26Å; I162-V183 HydrophobicContact CG1-CG1 4.03Å; I162-V183 HydrophobicContact CG1-CG2 4.42Å; I162-V183 HydrophobicContact CG2-CG1 4.26Å; A177-V183 HydrophobicContact CB-CB 4.37Å; A177-V183 HydrophobicContact CB-CG2 4.07Å; A177-V183 PolarHBondContact O-N 3.48Å; K181-V183 VanDerWaalsContact C-N 3.28Å; V183-V187 HydrophobicContact CG1-CB 4.11Å; V183-V187 HydrophobicContact CG1-CG1 3.65Å
184	D	94.3	Very high	91.5	Very high	105 Å²	105	65.8 Å²	65.8	56%	0.561	33%	0.325	S	S	*	.			trans	-70.5	133.5	168.3	-168.6	-24.2	0	0	0	109.2	N186 V187	D184-N186 PolarHBondContact O-N 3.27Å; D184-N186 VanDerWaalsContact O-N 3.15Å; D184-N186 PolarHBondContact OD1-N 2.95Å; D184-V187 VanDerWaalsContact O-CB 3.27Å; D184-V187 WeakPolarHBondContact O-CB 3.17Å; D184-V187 VanDerWaalsContact O-CG1 3.23Å; D184-V187 WeakPolarHBondContact O-CG1 3.48Å; D184-V187 PolarHBondContact O-N 3.45Å
185	V	96.1	Very high	91.7	Very high	13 Å²	13	65.8 Å²	65.8	8%	0.079	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-26.2	175.5	67.5	0	0	0	0	112.1	I178 L211 H214 A216	I178-V185 HydrophobicContact CD1-CB 4.26Å; I178-V185 HydrophobicContact CD1-CG2 3.96Å; I178-V185 HydrophobicContact CG1-CB 4.47Å; I178-V185 HydrophobicContact CG2-CB 4.31Å; V185-L211 HydrophobicContact CG2-CD2 3.98Å; V185-H214 HydrophobicContact CG2-CB 4.21Å; V185-A216 HydrophobicContact CG2-CB 3.81Å
186	N	96.9	Very high	91.8	Very high	53 Å²	53	64.9 Å²	64.9	28%	0.283	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	17.9	177.8	-62	-48.9	0	0	0	113.2	D184 K188 A216 D217	D184-N186 PolarHBondContact O-N 3.27Å; D184-N186 VanDerWaalsContact O-N 3.15Å; D184-N186 PolarHBondContact OD1-N 2.95Å; N186-K188 PolarHBondContact O-N 3.02Å; N186-A216 WeakPolarHBondContact OD1-CA 3.24Å; N186-D217 PolarHBondContact OD1-N 3.11Å
187	V	95.4	Very high	92	Very high	42 Å²	42	57.5 Å²	57.5	26%	0.255	29%	0.287	S	S	.	.			trans	-53.9	137.7	171	65.7	0	0	0	0	110	I162 F163 V183 D184 A194 L195	I162-V187 HydrophobicContact CG2-CG1 3.98Å; F163-V187 HydrophobicContact CE1-CG1 4.28Å; F163-V187 HydrophobicContact CE2-CG2 4.35Å; F163-V187 HydrophobicContact CZ-CB 4.42Å; F163-V187 HydrophobicContact CZ-CG1 3.83Å; F163-V187 HydrophobicContact CZ-CG2 4.08Å; V183-V187 HydrophobicContact CG1-CB 4.11Å; V183-V187 HydrophobicContact CG1-CG1 3.65Å; D184-V187 VanDerWaalsContact O-CB 3.27Å; D184-V187 WeakPolarHBondContact O-CB 3.17Å; D184-V187 VanDerWaalsContact O-CG1 3.23Å; D184-V187 WeakPolarHBondContact O-CG1 3.48Å; D184-V187 PolarHBondContact O-N 3.45Å; V187-A194 VanDerWaalsContact O-CA 3.29Å; V187-A194 WeakPolarHBondContact O-CA 3.47Å; V187-L195 HydrophobicContact CG1-CD1 4.09Å; V187-L195 HydrophobicContact CG1-CD2 4.49Å; V187-L195 HydrophobicContact CG1-CG 3.98Å
188	K	93.4	Very high	92	Very high	99 Å²	99	57.5 Å²	57.5	43%	0.43	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-115.7	144.5	-179.1	-67.6	-177.3	166.6	-155.7	0	110.9	N186 G192 R193 A194 Q221	N186-K188 PolarHBondContact O-N 3.02Å; K188-G192 WeakPolarHBondContact CD-O 3.45Å; K188-G192 WeakPolarHBondContact CE-O 2.9Å; K188-G192 WeakPolarHBondContact CG-O 3.48Å; K188-R193 WeakPolarHBondContact CA-O 3.36Å; K188-A194 HydrophobicContact CG-CB 4.48Å; K188-Q221 PolarHBondContact NZ-O 3.28Å
189	D	87.2	Confident	92.2	Very high	27 Å²	27	56.7 Å²	56.7	14%	0.144	28%	0.28	C	S	.	.			trans	-79.5	-173	168.8	64.4	14	0	0	0	111.4	F163 E191 G192 R193 W198	F163-D189 HydrophobicContact CD2-CB 4.17Å; F163-D189 HydrophobicContact CE1-CB 4.33Å; F163-D189 HydrophobicContact CE2-CB 3.91Å; F163-D189 HydrophobicContact CG-CB 4.5Å; F163-D189 HydrophobicContact CZ-CB 4Å; F163-D189 VanDerWaalsContact CZ-N 3.3Å; D189-E191 PolarHBondContact O-N 3.15Å; D189-E191 WeakPolarHBondContact OD1-CA 3.43Å; D189-E191 PolarHBondContact OD1-N 3.49Å; D189-E191 VanDerWaalsContact OD1-N 3.09Å; D189-G192 PolarHBondContact O-N 3.28Å; D189-G192 PolarHBondContact OD1-N 2.76Å; D189-G192 VanDerWaalsContact OD1-N 3.17Å; D189-R193 PolarHBondContact N-O 3.39Å; D189-R193 VanDerWaalsContact N-O 3.09Å; D189-R193 WeakPolarHBondContact OD1-CA 3.39Å; D189-R193 WeakPolarHBondContact OD1-CB 3.46Å; D189-R193 PolarHBondContact OD1-N 3.29Å; D189-R193 IonicContact OD1-NE 2.76Å; D189-R193 WeakPolarHBondContact OD2-CB 3.47Å; D189-R193 IonicContact OD2-CZ 3.02Å; D189-R193 IonicContact OD2-NE 3.65Å; D189-R193 PolarHBondContact OD2-NE 2.83Å; D189-R193 IonicContact OD2-NH2 3.79Å; D189-W198 VanDerWaalsContact OD2-CZ2 3.32Å; D189-W198 WeakPolarHBondContact OD2-CZ2 3.4Å; D189-W198 PolarHBondContact OD2-NE1 3.46Å
190	E	82.9	Confident	92.3	Very high	163 Å²	163	50 Å²	50	76%	0.762	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-26	-178.4	-59.3	-172.4	166.4	0	0	112.4	G192 N223	E190-G192 VanDerWaalsContact C-N 3.28Å; E190-N223 PolarHBondContact O-ND2 2.98Å
191	E	81.1	Confident	92.3	Very high	88 Å²	88	47.4 Å²	47.4	41%	0.411	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	6	174.4	-60.4	77	-151.8	0	0	113	D189 R193 N223	D189-E191 PolarHBondContact O-N 3.15Å; D189-E191 WeakPolarHBondContact OD1-CA 3.43Å; D189-E191 PolarHBondContact OD1-N 3.49Å; D189-E191 VanDerWaalsContact OD1-N 3.09Å; E191-R193 HydrophobicContact CB-CG 4.16Å; E191-R193 PolarHBondContact O-N 2.66Å; E191-R193 IonicContact OE2-CZ 3.67Å; E191-R193 IonicContact OE2-NE 3.98Å; E191-R193 IonicContact OE2-NH2 3.77Å; E191-R193 PolarHBondContact OE2-NH2 3.15Å; E191-N223 WeakPolarHBondContact CA-ND2 3.35Å; E191-N223 WeakPolarHBondContact O-CB 3.12Å; E191-N223 PolarHBondContact O-N 2.81Å; E191-N223 PolarHBondContact O-ND2 3.13Å
192	G	89.6	Confident	92.4	Very high	3 Å²	3	41 Å²	41	3%	0.031	20%	0.203	C	C	.	.			trans	76.1	8.2	179.9	0	0	0	0	0	113.7	K188 D189 E190 A194 D222	K188-G192 WeakPolarHBondContact CD-O 3.45Å; K188-G192 WeakPolarHBondContact CE-O 2.9Å; K188-G192 WeakPolarHBondContact CG-O 3.48Å; D189-G192 PolarHBondContact O-N 3.28Å; D189-G192 PolarHBondContact OD1-N 2.76Å; D189-G192 VanDerWaalsContact OD1-N 3.17Å; E190-G192 VanDerWaalsContact C-N 3.28Å; G192-A194 PolarHBondContact O-N 3.47Å; G192-D222 WeakPolarHBondContact O-CA 3.34Å
193	R	93.8	Very high	92.8	Very high	23 Å²	23	35.8 Å²	35.8	9%	0.087	18%	0.181	C	C	.	.			trans	-79.8	120.3	-178.5	-58.9	177.5	-71.4	-160	-13.7	110.1	E91 F163 K188 D189 E191 H197 W198 D222 Y231	E91-R193 IonicContact OE2-CZ 3.8Å; E91-R193 IonicContact OE2-NH1 3.68Å; E91-R193 PolarHBondContact OE2-NH1 2.95Å; F163-R193 WeakPolarHBondContact CE1-O 3.23Å; K188-R193 WeakPolarHBondContact CA-O 3.36Å; D189-R193 PolarHBondContact N-O 3.39Å; D189-R193 VanDerWaalsContact N-O 3.09Å; D189-R193 WeakPolarHBondContact OD1-CA 3.39Å; D189-R193 WeakPolarHBondContact OD1-CB 3.46Å; D189-R193 PolarHBondContact OD1-N 3.29Å; D189-R193 IonicContact OD1-NE 2.76Å; D189-R193 WeakPolarHBondContact OD2-CB 3.47Å; D189-R193 IonicContact OD2-CZ 3.02Å; D189-R193 IonicContact OD2-NE 3.65Å; D189-R193 PolarHBondContact OD2-NE 2.83Å; D189-R193 IonicContact OD2-NH2 3.79Å; E191-R193 HydrophobicContact CB-CG 4.16Å; E191-R193 PolarHBondContact O-N 2.66Å; E191-R193 IonicContact OE2-CZ 3.67Å; E191-R193 IonicContact OE2-NE 3.98Å; E191-R193 IonicContact OE2-NH2 3.77Å; E191-R193 PolarHBondContact OE2-NH2 3.15Å; R193-H197 HydrophobicContact CB-CB 4.13Å; R193-W198 VanDerWaalsContact CZ-CH2 3.43Å; R193-D222 HydrophobicContact CG-CB 3.95Å; R193-Y231 WeakPolarHBondContact CD-OH 3.47Å
194	A	97.4	Very high	93	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-73.1	163.5	168.6	0	0	0	0	0	113	V187 K188 G192 L196 H197 W198	V187-A194 VanDerWaalsContact O-CA 3.29Å; V187-A194 WeakPolarHBondContact O-CA 3.47Å; K188-A194 HydrophobicContact CG-CB 4.48Å; G192-A194 PolarHBondContact O-N 3.47Å; A194-L196 PolarHBondContact O-N 2.76Å; A194-L196 VanDerWaalsContact O-N 3.1Å; A194-H197 PolarHBondContact N-ND1 3.28Å; A194-H197 WeakPolarHBondContact O-CB 3.29Å; A194-H197 PolarHBondContact O-N 3.38Å; A194-W198 PolarHBondContact O-N 3.02Å
195	L	97.3	Very high	93.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-50.9	-35.7	174	-65.6	174.9	0	0	0	112.9	I162 F163 C166 I174 I178 V187 H197 W198 A199 L211	I162-L195 HydrophobicContact CG1-CD1 4.28Å; I162-L195 HydrophobicContact CG1-CD2 4.11Å; I162-L195 HydrophobicContact CG2-CD2 4.29Å; F163-L195 HydrophobicContact CD1-CD2 3.68Å; F163-L195 HydrophobicContact CE1-CD2 3.85Å; F163-L195 HydrophobicContact CE1-CG 4.28Å; F163-L195 HydrophobicContact CG-CD2 4.46Å; C166-L195 HydrophobicContact CB-CD2 3.73Å; C166-L195 PolarHBondContact SG-O 3.47Å; C166-L195 VanDerWaalsContact SG-O 3.42Å; I174-L195 HydrophobicContact CD1-CD2 4.3Å; I174-L195 HydrophobicContact CG2-CD1 4.44Å; I178-L195 HydrophobicContact CD1-CD1 4.43Å; V187-L195 HydrophobicContact CG1-CD1 4.09Å; V187-L195 HydrophobicContact CG1-CD2 4.49Å; V187-L195 HydrophobicContact CG1-CG 3.98Å; L195-H197 VanDerWaalsContact C-N 3.33Å; L195-H197 PolarHBondContact O-N 3.42Å; L195-W198 PolarHBondContact O-N 2.85Å; L195-A199 PolarHBondContact O-N 3.33Å; L195-L211 HydrophobicContact CB-CD1 3.89Å; L195-L211 HydrophobicContact CB-CD2 3.92Å; L195-L211 HydrophobicContact CD1-CD2 4.01Å
196	L	98.5	Very high	93.3	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-36.5	179	-170.2	64.5	0	0	0	112.3	A194 A199 C200 V208 L211 L212 A216 I218 A228	A194-L196 PolarHBondContact O-N 2.76Å; A194-L196 VanDerWaalsContact O-N 3.1Å; L196-A199 PolarHBondContact O-N 2.89Å; L196-C200 WeakPolarHBondContact O-CB 3.28Å; L196-C200 PolarHBondContact O-N 3.27Å; L196-C200 PolarHBondContact O-SG 3.5Å; L196-V208 HydrophobicContact CD1-CB 4.47Å; L196-V208 HydrophobicContact CD1-CG1 3.97Å; L196-L211 HydrophobicContact CB-CD1 4.47Å; L196-L211 HydrophobicContact CD1-CB 4.19Å; L196-L211 HydrophobicContact CD1-CD1 4.33Å; L196-L212 HydrophobicContact CD1-CD2 4.27Å; L196-L212 HydrophobicContact CD1-CG 4.26Å; L196-L212 HydrophobicContact CD2-CD2 4.01Å; L196-A216 HydrophobicContact CB-CB 4.46Å; L196-A216 HydrophobicContact CD2-CB 4.27Å; L196-I218 HydrophobicContact CD2-CG1 4.43Å; L196-A228 HydrophobicContact CB-CB 4.42Å; L196-A228 HydrophobicContact CD2-CB 3.91Å; L196-A228 HydrophobicContact CG-CB 3.7Å
197	H	97.7	Very high	93.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.1	-49.4	174.7	-61.4	93.5	0	0	0	110.5	R193 A194 L195 A199 C200 D201 C220 Q226 A228 Y231	R193-H197 HydrophobicContact CB-CB 4.13Å; A194-H197 PolarHBondContact N-ND1 3.28Å; A194-H197 WeakPolarHBondContact O-CB 3.29Å; A194-H197 PolarHBondContact O-N 3.38Å; L195-H197 VanDerWaalsContact C-N 3.33Å; L195-H197 PolarHBondContact O-N 3.42Å; H197-A199 PolarHBondContact O-N 3Å; H197-C200 PolarHBondContact O-N 3.17Å; H197-D201 VanDerWaalsContact O-CB 3.24Å; H197-D201 WeakPolarHBondContact O-CB 3.22Å; H197-D201 PolarHBondContact O-N 3.17Å; H197-C220 PolarHBondContact CE1-SG 3.45Å; H197-C220 PolarHBondContact NE2-O 3.05Å; H197-Q226 PolarHBondContact NE2-O 3.29Å; H197-Q226 VanDerWaalsContact NE2-O 3.15Å; H197-A228 PolarHBondContact CD2-N 2.98Å; H197-A228 VanDerWaalsContact CD2-N 3.33Å; H197-A228 PolarHBondContact NE2-N 3.12Å; H197-Y231 HydrophobicContact CB-CD2 4.25Å; H197-Y231 HydrophobicContact CB-CE2 4.19Å; H197-Y231 AromaticContact CD2-CD2 3.68Å; H197-Y231 AromaticContact CD2-CE2 3.57Å
198	W	94.4	Very high	93.5	Very high	13 Å²	13	34.5 Å²	34.5	5%	0.049	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-41.2	178.7	-74.2	104.7	0	0	0	113	F163 R167 D189 R193 A194 L195 C200 D201 R202	F163-W198 AromaticContact CD1-CD1 3.55Å; F163-W198 AromaticContact CD1-NE1 3.65Å; R167-W198 HydrophobicContact CG-CD2 4.16Å; R167-W198 HydrophobicContact CG-CE3 3.64Å; R167-W198 HydrophobicContact CG-CZ3 3.98Å; D189-W198 VanDerWaalsContact OD2-CZ2 3.32Å; D189-W198 WeakPolarHBondContact OD2-CZ2 3.4Å; D189-W198 PolarHBondContact OD2-NE1 3.46Å; R193-W198 VanDerWaalsContact CZ-CH2 3.43Å; A194-W198 PolarHBondContact O-N 3.02Å; L195-W198 PolarHBondContact O-N 2.85Å; W198-C200 VanDerWaalsContact C-N 3.34Å; W198-C200 PolarHBondContact O-N 2.68Å; W198-D201 PolarHBondContact O-N 3.21Å; W198-R202 WeakPolarHBondContact O-CB 3.47Å; W198-R202 VanDerWaalsContact O-CG 3.24Å; W198-R202 WeakPolarHBondContact O-CG 3.42Å; W198-R202 PolarHBondContact O-N 2.88Å
199	A	96.4	Very high	93.7	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-39.9	176.7	0	0	0	0	0	112	L195 L196 H197 G203 H204 L207 V208 L211	L195-A199 PolarHBondContact O-N 3.33Å; L196-A199 PolarHBondContact O-N 2.89Å; H197-A199 PolarHBondContact O-N 3Å; A199-G203 PolarHBondContact O-N 3.24Å; A199-H204 PolarHBondContact O-N 3.21Å; A199-L207 HydrophobicContact CB-CB 4.29Å; A199-L207 HydrophobicContact CB-CD2 3.98Å; A199-L207 HydrophobicContact CB-CG 3.94Å; A199-V208 HydrophobicContact CB-CG2 3.67Å; A199-L211 HydrophobicContact CB-CD1 3.85Å
200	C	95.8	Very high	94.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-71.1	-41.1	176.2	-71.1	0	0	0	0	112.8	L196 H197 W198 R202 G203 A228 A232 F237 I240	L196-C200 WeakPolarHBondContact O-CB 3.28Å; L196-C200 PolarHBondContact O-N 3.27Å; L196-C200 PolarHBondContact O-SG 3.5Å; H197-C200 PolarHBondContact O-N 3.17Å; W198-C200 VanDerWaalsContact C-N 3.34Å; W198-C200 PolarHBondContact O-N 2.68Å; C200-R202 VanDerWaalsContact C-N 3.29Å; C200-R202 PolarHBondContact O-N 2.98Å; C200-G203 PolarHBondContact O-N 3.39Å; C200-A228 HydrophobicContact CB-CB 4.37Å; C200-A228 WeakPolarHBondContact CB-O 3.47Å; C200-A232 HydrophobicContact CB-CB 4.15Å; C200-F237 VanDerWaalsContact O-CD2 3.23Å; C200-F237 WeakPolarHBondContact O-CD2 3.29Å; C200-F237 WeakPolarHBondContact O-CE2 3.4Å; C200-I240 HydrophobicContact CB-CG2 4.4Å
201	D	91.8	Very high	95	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-58.9	-38.9	175.7	174.6	57.4	0	0	0	112.7	D89 F90 H197 W198 Y231 F237	D89-D201 WeakPolarHBondContact CB-OD2 3.13Å; F90-D201 WeakPolarHBondContact CA-OD1 3.48Å; F90-D201 WeakPolarHBondContact CB-OD1 3.35Å; F90-D201 PolarHBondContact N-OD1 3.19Å; H197-D201 VanDerWaalsContact O-CB 3.24Å; H197-D201 WeakPolarHBondContact O-CB 3.22Å; H197-D201 PolarHBondContact O-N 3.17Å; W198-D201 PolarHBondContact O-N 3.21Å; D201-Y231 HydrophobicContact CB-CD1 3.82Å; D201-Y231 HydrophobicContact CB-CG 4.5Å; D201-F237 WeakPolarHBondContact O-CE2 3.48Å
202	R	86.7	Confident	95.8	Very high	56 Å²	56	21.5 Å²	21.5	21%	0.211	11%	0.109	C	C	.	.	H	α-helix	trans	-89.2	-9.6	-177.7	-66.2	-65.4	-149.3	-171.6	-1.6	114.9	D89 W198 C200 H204	D89-R202 IonicContact OD2-CZ 2.79Å; D89-R202 IonicContact OD2-NH1 2.92Å; D89-R202 PolarHBondContact OD2-NH1 3.1Å; D89-R202 IonicContact OD2-NH2 3.08Å; W198-R202 WeakPolarHBondContact O-CB 3.47Å; W198-R202 VanDerWaalsContact O-CG 3.24Å; W198-R202 WeakPolarHBondContact O-CG 3.42Å; W198-R202 PolarHBondContact O-N 2.88Å; C200-R202 VanDerWaalsContact C-N 3.29Å; C200-R202 PolarHBondContact O-N 2.98Å; R202-H204 VanDerWaalsContact CB-CD2 3.47Å; R202-H204 WeakPolarHBondContact CB-CD2 3.36Å; R202-H204 WeakPolarHBondContact CB-NE2 3.42Å
203	G	91	Very high	96.2	Very high	26 Å²	26	28.1 Å²	28.1	27%	0.268	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	19.6	-177.5	0	0	0	0	0	114.4	A199 C200 K205 I240	A199-G203 PolarHBondContact O-N 3.24Å; C200-G203 PolarHBondContact O-N 3.39Å; G203-K205 PolarHBondContact O-N 3Å; G203-I240 VanDerWaalsContact C-CD1 3.45Å; G203-I240 VanDerWaalsContact CA-CD1 3.49Å
204	H	96.1	Very high	96.3	Very high	32 Å²	32	29.4 Å²	29.4	15%	0.148	15%	0.146	C	C	.	.			trans	-84.7	72.6	-175.2	-63.3	-26.9	0	0	0	111.7	C166 R167 N169 A199 R202 E206 L207 V208	C166-H204 PolarHBondContact O-CD2 3.08Å; R167-H204 PolarHBondContact O-NE2 3.48Å; N169-H204 WeakPolarHBondContact OD1-CB 3.23Å; A199-H204 PolarHBondContact O-N 3.21Å; R202-H204 VanDerWaalsContact CB-CD2 3.47Å; R202-H204 WeakPolarHBondContact CB-CD2 3.36Å; R202-H204 WeakPolarHBondContact CB-NE2 3.42Å; H204-E206 PolarHBondContact O-N 3.21Å; H204-L207 HydrophobicContact CB-CB 3.83Å; H204-L207 HydrophobicContact CB-CD2 4.33Å; H204-L207 WeakPolarHBondContact O-CA 3.43Å; H204-L207 WeakPolarHBondContact O-CB 3.42Å; H204-L207 PolarHBondContact O-N 2.93Å; H204-V208 WeakPolarHBondContact O-CG2 3.3Å; H204-V208 PolarHBondContact O-N 2.97Å
205	K	97.6	Very high	96.3	Very high	68 Å²	68	39.9 Å²	39.9	30%	0.296	19%	0.186	S	C	.	.	H	α-helix	trans	-56.3	-43.1	-174.3	-178.8	173.7	-179.2	-179	0	115	G203 L207 V208 T209 D239 I240 L243	G203-K205 PolarHBondContact O-N 3Å; K205-L207 VanDerWaalsContact C-N 3.29Å; K205-L207 PolarHBondContact O-N 3.23Å; K205-V208 WeakPolarHBondContact O-CB 3.44Å; K205-V208 PolarHBondContact O-N 3.41Å; K205-T209 PolarHBondContact O-N 3.03Å; K205-T209 PolarHBondContact O-OG1 3.41Å; K205-D239 HydrophobicContact CD-CB 4.47Å; K205-D239 WeakPolarHBondContact CD-OD2 3.16Å; K205-D239 IonicContact NZ-OD2 3.76Å; K205-D239 PolarHBondContact NZ-OD2 3.42Å; K205-I240 HydrophobicContact CB-CD1 4.2Å; K205-I240 HydrophobicContact CB-CG1 3.89Å; K205-I240 HydrophobicContact CG-CG1 4.25Å; K205-L243 HydrophobicContact CG-CD2 4.05Å
206	E	97.9	Very high	96.3	Very high	121 Å²	121	40.3 Å²	40.3	57%	0.565	19%	0.19	S	C	*	.	H	α-helix	trans	-61.8	-40.4	176.5	-78.5	66.2	-150.8	0	0	110.9	I171 H204 T209 V210	I171-E206 HydrophobicContact CD1-CB 3.64Å; H204-E206 PolarHBondContact O-N 3.21Å; E206-T209 WeakPolarHBondContact O-CB 3.28Å; E206-T209 PolarHBondContact O-N 2.9Å; E206-V210 WeakPolarHBondContact O-CG2 3.27Å; E206-V210 PolarHBondContact O-N 2.92Å
207	L	98.1	Very high	96.3	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.3	-42	175.7	-177.2	57.6	0	0	0	111.7	I171 I174 A199 H204 K205 T209 V210 L211	I171-L207 HydrophobicContact CD1-CB 4.43Å; I171-L207 HydrophobicContact CG1-CB 4.09Å; I171-L207 HydrophobicContact CG1-CD1 4.14Å; I174-L207 HydrophobicContact CB-CD1 4.23Å; I174-L207 HydrophobicContact CG1-CD1 4.31Å; I174-L207 HydrophobicContact CG2-CD1 4Å; A199-L207 HydrophobicContact CB-CB 4.29Å; A199-L207 HydrophobicContact CB-CD2 3.98Å; A199-L207 HydrophobicContact CB-CG 3.94Å; H204-L207 HydrophobicContact CB-CB 3.83Å; H204-L207 HydrophobicContact CB-CD2 4.33Å; H204-L207 WeakPolarHBondContact O-CA 3.43Å; H204-L207 WeakPolarHBondContact O-CB 3.42Å; H204-L207 PolarHBondContact O-N 2.93Å; K205-L207 VanDerWaalsContact C-N 3.29Å; K205-L207 PolarHBondContact O-N 3.23Å; L207-T209 VanDerWaalsContact C-N 3.27Å; L207-T209 PolarHBondContact O-N 2.95Å; L207-V210 PolarHBondContact O-N 3.35Å; L207-L211 HydrophobicContact CD1-CD1 4.37Å; L207-L211 HydrophobicContact CD1-CG 4.17Å; L207-L211 HydrophobicContact CG-CD1 4.08Å; L207-L211 HydrophobicContact CG-CG 4.36Å; L207-L211 VanDerWaalsContact O-CG 3.28Å; L207-L211 WeakPolarHBondContact O-CG 3.45Å; L207-L211 PolarHBondContact O-N 3.4Å
208	V	98.6	Very high	96.4	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-53.9	-47.5	171.9	172.6	0	0	0	0	110.2	L196 A199 H204 K205 V210 L211 L212 I240 L243 L244	L196-V208 HydrophobicContact CD1-CB 4.47Å; L196-V208 HydrophobicContact CD1-CG1 3.97Å; A199-V208 HydrophobicContact CB-CG2 3.67Å; H204-V208 WeakPolarHBondContact O-CG2 3.3Å; H204-V208 PolarHBondContact O-N 2.97Å; K205-V208 WeakPolarHBondContact O-CB 3.44Å; K205-V208 PolarHBondContact O-N 3.41Å; V208-V210 PolarHBondContact O-N 3.43Å; V208-L211 PolarHBondContact O-N 3.1Å; V208-L212 HydrophobicContact CG1-CD1 3.92Å; V208-L212 HydrophobicContact CG1-CG 4.46Å; V208-L212 VanDerWaalsContact O-CG 3.28Å; V208-L212 WeakPolarHBondContact O-CG 3.28Å; V208-L212 PolarHBondContact O-N 3.25Å; V208-I240 HydrophobicContact CG1-CG2 4.45Å; V208-I240 HydrophobicContact CG2-CG2 4.16Å; V208-L243 HydrophobicContact CB-CD2 4.18Å; V208-L243 HydrophobicContact CG1-CD2 3.68Å; V208-L243 HydrophobicContact CG1-CG 4.43Å; V208-L244 HydrophobicContact CG1-CD2 4.08Å
209	T	98.5	Very high	96.5	Very high	48 Å²	48	46.8 Å²	46.8	29%	0.294	23%	0.225	S	C	.	.	H	α-helix	trans	-59.1	-46.5	178.3	-57	0	0	0	0	111.6	K205 E206 L207 L212 Q213 L243	K205-T209 PolarHBondContact O-N 3.03Å; K205-T209 PolarHBondContact O-OG1 3.41Å; E206-T209 WeakPolarHBondContact O-CB 3.28Å; E206-T209 PolarHBondContact O-N 2.9Å; L207-T209 VanDerWaalsContact C-N 3.27Å; L207-T209 PolarHBondContact O-N 2.95Å; T209-L212 PolarHBondContact O-N 3.5Å; T209-Q213 VanDerWaalsContact O-CG 3.29Å; T209-Q213 WeakPolarHBondContact O-CG 3.34Å; T209-Q213 PolarHBondContact O-N 3.41Å; T209-L243 WeakPolarHBondContact OG1-CD2 3.5Å
210	V	98.2	Very high	96.6	Very high	23 Å²	23	47.3 Å²	47.3	14%	0.139	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-45.4	178.9	167.5	0	0	0	0	111.8	I171 T175 E206 L207 V208 L212 Q213 H214	I171-V210 HydrophobicContact CG2-CB 4.47Å; I171-V210 HydrophobicContact CG2-CG1 4.41Å; I171-V210 HydrophobicContact CG2-CG2 3.9Å; T175-V210 WeakPolarHBondContact OG1-CG1 3.5Å; E206-V210 WeakPolarHBondContact O-CG2 3.27Å; E206-V210 PolarHBondContact O-N 2.92Å; L207-V210 PolarHBondContact O-N 3.35Å; V208-V210 PolarHBondContact O-N 3.43Å; V210-L212 VanDerWaalsContact C-N 3.33Å; V210-L212 PolarHBondContact O-N 2.86Å; V210-Q213 WeakPolarHBondContact O-CB 3.38Å; V210-Q213 PolarHBondContact O-N 3.09Å; V210-H214 PolarHBondContact O-CD2 2.89Å; V210-H214 PolarHBondContact O-N 2.99Å
211	L	98.4	Very high	96.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-43.5	178.9	-69	172.5	0	0	0	111.1	I174 I178 V185 L195 L196 A199 L207 V208 H214 R215 A216	I174-L211 HydrophobicContact CG2-CD2 3.98Å; I178-L211 HydrophobicContact CD1-CD2 3.81Å; V185-L211 HydrophobicContact CG2-CD2 3.98Å; L195-L211 HydrophobicContact CB-CD1 3.89Å; L195-L211 HydrophobicContact CB-CD2 3.92Å; L195-L211 HydrophobicContact CD1-CD2 4.01Å; L196-L211 HydrophobicContact CB-CD1 4.47Å; L196-L211 HydrophobicContact CD1-CB 4.19Å; L196-L211 HydrophobicContact CD1-CD1 4.33Å; A199-L211 HydrophobicContact CB-CD1 3.85Å; L207-L211 HydrophobicContact CD1-CD1 4.37Å; L207-L211 HydrophobicContact CD1-CG 4.17Å; L207-L211 HydrophobicContact CG-CD1 4.08Å; L207-L211 HydrophobicContact CG-CG 4.36Å; L207-L211 VanDerWaalsContact O-CG 3.28Å; L207-L211 WeakPolarHBondContact O-CG 3.45Å; L207-L211 PolarHBondContact O-N 3.4Å; V208-L211 PolarHBondContact O-N 3.1Å; L211-H214 CarbonylContact O-C 3.47Å; L211-H214 WeakPolarHBondContact O-CA 3.2Å; L211-H214 PolarHBondContact O-N 3.42Å; L211-H214 VanDerWaalsContact O-N 3.14Å; L211-R215 PolarHBondContact O-N 2.9Å; L211-A216 HydrophobicContact CB-CB 4.07Å; L211-A216 VanDerWaalsContact O-CB 3.25Å; L211-A216 WeakPolarHBondContact O-CB 3.11Å; L211-A216 PolarHBondContact O-N 3.46Å
212	L	98.3	Very high	96.9	Very high	33 Å²	33	51.4 Å²	51.4	17%	0.173	25%	0.248	C	C	.	.	H	α-helix	trans	-65.3	-40.2	176.2	-67.6	174.1	0	0	0	112.6	L196 V208 T209 V210 H214 R215 I218 L244	L196-L212 HydrophobicContact CD1-CD2 4.27Å; L196-L212 HydrophobicContact CD1-CG 4.26Å; L196-L212 HydrophobicContact CD2-CD2 4.01Å; V208-L212 HydrophobicContact CG1-CD1 3.92Å; V208-L212 HydrophobicContact CG1-CG 4.46Å; V208-L212 VanDerWaalsContact O-CG 3.28Å; V208-L212 WeakPolarHBondContact O-CG 3.28Å; V208-L212 PolarHBondContact O-N 3.25Å; T209-L212 PolarHBondContact O-N 3.5Å; V210-L212 VanDerWaalsContact C-N 3.33Å; V210-L212 PolarHBondContact O-N 2.86Å; L212-H214 PolarHBondContact O-N 3.45Å; L212-R215 PolarHBondContact O-N 3.38Å; L212-I218 HydrophobicContact CD1-CD1 4.44Å; L212-I218 HydrophobicContact CD2-CB 4.02Å; L212-I218 HydrophobicContact CD2-CD1 3.84Å; L212-I218 HydrophobicContact CD2-CG1 3.95Å; L212-L244 HydrophobicContact CD1-CD2 4.33Å
213	Q	97.6	Very high	97.1	Very high	142 Å²	142	53.2 Å²	53.2	66%	0.664	26%	0.262	S	S	*	.	H	α-helix	trans	-59.5	-31.9	172.8	-74.8	173.9	-1	0	0	112.3	T209 V210 R215	T209-Q213 VanDerWaalsContact O-CG 3.29Å; T209-Q213 WeakPolarHBondContact O-CG 3.34Å; T209-Q213 PolarHBondContact O-N 3.41Å; V210-Q213 WeakPolarHBondContact O-CB 3.38Å; V210-Q213 PolarHBondContact O-N 3.09Å; Q213-R215 VanDerWaalsContact C-N 3.25Å; Q213-R215 PolarHBondContact O-N 2.81Å
214	H	96.7	Very high	97	Very high	51 Å²	51	55 Å²	55	24%	0.236	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	13.6	175	-81.3	-74.5	0	0	0	114.1	I178 V185 V210 L211 L212	I178-H214 HydrophobicContact CG2-CB 4.01Å; V185-H214 HydrophobicContact CG2-CB 4.21Å; V210-H214 PolarHBondContact O-CD2 2.89Å; V210-H214 PolarHBondContact O-N 2.99Å; L211-H214 CarbonylContact O-C 3.47Å; L211-H214 WeakPolarHBondContact O-CA 3.2Å; L211-H214 PolarHBondContact O-N 3.42Å; L211-H214 VanDerWaalsContact O-N 3.14Å; L212-H214 PolarHBondContact O-N 3.45Å
215	R	96.5	Very high	97	Very high	219 Å²	219	53.8 Å²	53.8	83%	0.826	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	37.6	177.4	-50.5	-176.4	177.4	-138.9	-1	114	L211 L212 Q213 D217	L211-R215 PolarHBondContact O-N 2.9Å; L212-R215 PolarHBondContact O-N 3.38Å; Q213-R215 VanDerWaalsContact C-N 3.25Å; Q213-R215 PolarHBondContact O-N 2.81Å; R215-D217 PolarHBondContact O-N 3.4Å
216	A	98	Very high	96.9	Very high	10 Å²	10	51 Å²	51	8%	0.083	25%	0.248	C	C	.	.			trans	-52.8	137	162.1	0	0	0	0	0	110.1	V185 N186 L196 L211 I218	V185-A216 HydrophobicContact CG2-CB 3.81Å; N186-A216 WeakPolarHBondContact OD1-CA 3.24Å; L196-A216 HydrophobicContact CB-CB 4.46Å; L196-A216 HydrophobicContact CD2-CB 4.27Å; L211-A216 HydrophobicContact CB-CB 4.07Å; L211-A216 VanDerWaalsContact O-CB 3.25Å; L211-A216 WeakPolarHBondContact O-CB 3.11Å; L211-A216 PolarHBondContact O-N 3.46Å; A216-I218 PolarHBondContact O-N 2.89Å; A216-I218 VanDerWaalsContact O-N 3.1Å
217	D	98.4	Very high	96.9	Very high	79 Å²	79	45.3 Å²	45.3	42%	0.422	22%	0.221	S	C	.	.			trans	-70.7	103.7	173.9	-178.9	2.4	0	0	0	109	N186 R215 N219 C220	N186-D217 PolarHBondContact OD1-N 3.11Å; R215-D217 PolarHBondContact O-N 3.4Å; D217-N219 PolarHBondContact O-N 3.46Å; D217-N219 PolarHBondContact OD1-N 3.36Å; D217-N219 VanDerWaalsContact OD1-N 3.1Å; D217-C220 HydrophobicContact CB-CB 3.97Å; D217-C220 PolarHBondContact O-N 3.19Å; D217-C220 PolarHBondContact O-SG 2.98Å; D217-C220 PolarHBondContact OD1-N 3.25Å
218	I	98.6	Very high	97	Very high	20 Å²	20	45.3 Å²	45.3	10%	0.103	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.7	-175.5	-163.4	165.4	0	0	0	113.5	L196 L212 A216 L244 A249	L196-I218 HydrophobicContact CD2-CG1 4.43Å; L212-I218 HydrophobicContact CD1-CD1 4.44Å; L212-I218 HydrophobicContact CD2-CB 4.02Å; L212-I218 HydrophobicContact CD2-CD1 3.84Å; L212-I218 HydrophobicContact CD2-CG1 3.95Å; A216-I218 PolarHBondContact O-N 2.89Å; A216-I218 VanDerWaalsContact O-N 3.1Å; I218-L244 HydrophobicContact CD1-CD2 4.08Å; I218-L244 VanDerWaalsContact CD1-O 3.31Å; I218-L244 WeakPolarHBondContact CD1-O 3.44Å; I218-L244 HydrophobicContact CG1-CD2 4.01Å; I218-A249 HydrophobicContact CD1-CB 3.87Å; I218-A249 HydrophobicContact CG1-CB 3.91Å
219	N	98.4	Very high	96.9	Very high	50 Å²	50	45.4 Å²	45.4	27%	0.267	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	11	-175.5	-69.2	-38	0	0	0	112.5	D217 Q221 A249 D250 L253	D217-N219 PolarHBondContact O-N 3.46Å; D217-N219 PolarHBondContact OD1-N 3.36Å; D217-N219 VanDerWaalsContact OD1-N 3.1Å; N219-Q221 PolarHBondContact O-N 3.12Å; N219-A249 WeakPolarHBondContact OD1-CA 3.47Å; N219-D250 PolarHBondContact OD1-N 3.14Å; N219-L253 HydrophobicContact CB-CD1 3.76Å
220	C	98.1	Very high	96.9	Very high	12 Å²	12	43.1 Å²	43.1	8%	0.081	21%	0.207	C	C	.	.			trans	-61.1	141.3	174	66.7	0	0	0	0	110.4	H197 D217	H197-C220 PolarHBondContact CE1-SG 3.45Å; H197-C220 PolarHBondContact NE2-O 3.05Å; D217-C220 HydrophobicContact CB-CB 3.97Å; D217-C220 PolarHBondContact O-N 3.19Å; D217-C220 PolarHBondContact O-SG 2.98Å; D217-C220 PolarHBondContact OD1-N 3.25Å
221	Q	97.9	Very high	96.8	Very high	79 Å²	79	42.5 Å²	42.5	37%	0.369	20%	0.203	S	C	.	.	B	Isolated β-bridge	trans	-105.8	140.5	176.9	-67.9	179.6	-73.5	0	0	109.9	K188 N219 G225 Q226 T227 R254	K188-Q221 PolarHBondContact NZ-O 3.28Å; N219-Q221 PolarHBondContact O-N 3.12Å; Q221-G225 WeakPolarHBondContact CG-O 3.1Å; Q221-G225 PolarHBondContact NE2-O 3.01Å; Q221-Q226 WeakPolarHBondContact CA-O 3.32Å; Q221-T227 HydrophobicContact CG-CG2 3.75Å; Q221-R254 PolarHBondContact NE2-O 2.93Å
222	D	94.8	Very high	96.6	Very high	11 Å²	11	42.5 Å²	42.5	6%	0.059	20%	0.203	C	C	.	.			trans	-77.6	-172.4	169.4	70.7	10.2	0	0	0	112.1	G192 R193 E224 G225 Q226 Y231	G192-D222 WeakPolarHBondContact O-CA 3.34Å; R193-D222 HydrophobicContact CG-CB 3.95Å; D222-E224 PolarHBondContact O-N 2.79Å; D222-E224 WeakPolarHBondContact OD1-CA 2.84Å; D222-E224 PolarHBondContact OD1-N 3.08Å; D222-G225 PolarHBondContact O-N 3.47Å; D222-G225 PolarHBondContact OD1-N 3.2Å; D222-G225 VanDerWaalsContact OD1-N 3.14Å; D222-Q226 PolarHBondContact N-O 2.62Å; D222-Q226 PolarHBondContact OD1-N 2.89Å; D222-Y231 WeakPolarHBondContact OD2-CE2 3.5Å; D222-Y231 PolarHBondContact OD2-OH 2.91Å
223	N	91.3	Very high	96.5	Very high	94 Å²	94	41 Å²	41	50%	0.503	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-9.2	-179.3	-67	-10.7	0	0	0	113.7	E190 E191 Q256	E190-N223 PolarHBondContact O-ND2 2.98Å; E191-N223 WeakPolarHBondContact CA-ND2 3.35Å; E191-N223 WeakPolarHBondContact O-CB 3.12Å; E191-N223 PolarHBondContact O-N 2.81Å; E191-N223 PolarHBondContact O-ND2 3.13Å; N223-Q256 PolarHBondContact O-NE2 3.06Å; N223-Q256 PolarHBondContact O-OE1 3.48Å
224	E	90.2	Very high	96.1	Very high	62 Å²	62	34.3 Å²	34.3	29%	0.29	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	5.9	172.8	-66	-176.6	-173.1	0	0	111.5	R62 D222 Q226 Q256	R62-E224 WeakPolarHBondContact CD-OE1 3.37Å; R62-E224 IonicContact CZ-OE1 2.66Å; R62-E224 IonicContact NE-OE1 3.46Å; R62-E224 PolarHBondContact NE-OE1 3.09Å; R62-E224 IonicContact NE-OE2 3.03Å; D222-E224 PolarHBondContact O-N 2.79Å; D222-E224 WeakPolarHBondContact OD1-CA 2.84Å; D222-E224 PolarHBondContact OD1-N 3.08Å; E224-Q226 HydrophobicContact CB-CG 4.2Å; E224-Q226 PolarHBondContact O-N 3.34Å; E224-Q256 WeakPolarHBondContact O-CB 3.45Å; E224-Q256 VanDerWaalsContact O-CG 3.31Å; E224-Q256 WeakPolarHBondContact O-CG 3.39Å; E224-Q256 PolarHBondContact O-N 3.25Å
225	G	94.4	Very high	95.7	Very high	7 Å²	7	32.9 Å²	32.9	7%	0.072	16%	0.159	C	C	.	.	S	Bend	trans	75.9	5.6	-175.7	0	0	0	0	0	113.3	Q221 D222 D255	Q221-G225 WeakPolarHBondContact CG-O 3.1Å; Q221-G225 PolarHBondContact NE2-O 3.01Å; D222-G225 PolarHBondContact O-N 3.47Å; D222-G225 PolarHBondContact OD1-N 3.2Å; D222-G225 VanDerWaalsContact OD1-N 3.14Å; G225-D255 WeakPolarHBondContact O-CA 3.28Å
226	Q	96.7	Very high	95.5	Very high	11 Å²	11	26.5 Å²	26.5	5%	0.051	14%	0.139	C	C	.	.			trans	-81.5	137.8	-177.2	-64.7	-177.6	-22.6	0	0	110.3	H197 Q221 D222 E224 H230 Y231 D255	H197-Q226 PolarHBondContact NE2-O 3.29Å; H197-Q226 VanDerWaalsContact NE2-O 3.15Å; Q221-Q226 WeakPolarHBondContact CA-O 3.32Å; D222-Q226 PolarHBondContact N-O 2.62Å; D222-Q226 PolarHBondContact OD1-N 2.89Å; E224-Q226 HydrophobicContact CB-CG 4.2Å; E224-Q226 PolarHBondContact O-N 3.34Å; Q226-H230 HydrophobicContact CB-CB 4.12Å; Q226-H230 HydrophobicContact CG-CB 4.43Å; Q226-Y231 HydrophobicContact CB-CD2 4.31Å; Q226-Y231 HydrophobicContact CB-CE2 3.72Å; Q226-D255 HydrophobicContact CG-CB 3.79Å
227	T	98.4	Very high	95.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-97.1	164.2	173	67.4	0	0	0	0	110.4	Q221 L229 H230 Y231 L253	Q221-T227 HydrophobicContact CG-CG2 3.75Å; T227-L229 PolarHBondContact O-N 3.17Å; T227-L229 PolarHBondContact OG1-N 2.98Å; T227-H230 PolarHBondContact N-ND1 3.26Å; T227-H230 VanDerWaalsContact N-ND1 3.14Å; T227-H230 WeakPolarHBondContact O-CB 3.38Å; T227-H230 PolarHBondContact O-N 3.21Å; T227-H230 PolarHBondContact OG1-ND1 3.34Å; T227-Y231 WeakPolarHBondContact O-CD2 3.09Å; T227-Y231 PolarHBondContact O-N 3.45Å; T227-L253 HydrophobicContact CG2-CB 4.14Å; T227-L253 HydrophobicContact CG2-CD1 3.81Å
228	A	98.2	Very high	95.1	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-52.4	-29.3	172.8	0	0	0	0	0	113.7	L196 H197 C200 Y231 A232 L244	L196-A228 HydrophobicContact CB-CB 4.42Å; L196-A228 HydrophobicContact CD2-CB 3.91Å; L196-A228 HydrophobicContact CG-CB 3.7Å; H197-A228 PolarHBondContact CD2-N 2.98Å; H197-A228 VanDerWaalsContact CD2-N 3.33Å; H197-A228 PolarHBondContact NE2-N 3.12Å; C200-A228 HydrophobicContact CB-CB 4.37Å; C200-A228 WeakPolarHBondContact CB-O 3.47Å; A228-Y231 PolarHBondContact O-N 2.86Å; A228-A232 PolarHBondContact O-N 3.44Å; A228-L244 HydrophobicContact CB-CD1 4.48Å
229	L	98.5	Very high	95.1	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-69.8	-34.1	175.3	-171.1	61.1	0	0	0	112.9	T227 S233 V241 L244 L245 A249 P251 P261 L274	T227-L229 PolarHBondContact O-N 3.17Å; T227-L229 PolarHBondContact OG1-N 2.98Å; L229-S233 VanDerWaalsContact O-CB 3.24Å; L229-S233 WeakPolarHBondContact O-CB 3.37Å; L229-S233 PolarHBondContact O-N 3.45Å; L229-S233 PolarHBondContact O-OG 3.1Å; L229-V241 HydrophobicContact CD1-CB 4.45Å; L229-V241 HydrophobicContact CD1-CG1 4.09Å; L229-V241 HydrophobicContact CD1-CG2 4.41Å; L229-L244 HydrophobicContact CB-CD1 4.24Å; L229-L244 HydrophobicContact CD1-CB 4.04Å; L229-L244 HydrophobicContact CD1-CD1 3.94Å; L229-L245 HydrophobicContact CD1-CG 4.36Å; L229-L245 HydrophobicContact CD2-CD2 3.9Å; L229-A249 HydrophobicContact CD2-CB 4.07Å; L229-P251 HydrophobicContact CD2-CB 4.03Å; L229-P261 HydrophobicContact CB-CG 4.38Å; L229-P261 HydrophobicContact CD2-CB 4.22Å; L229-P261 HydrophobicContact CD2-CG 4.03Å; L229-P261 HydrophobicContact CG-CB 3.93Å; L229-P261 HydrophobicContact CG-CG 4.07Å; L229-L274 HydrophobicContact CD1-CD2 4.04Å; L229-L274 HydrophobicContact CD2-CD2 3.89Å; L229-L274 HydrophobicContact CG-CD2 4.06Å
230	H	97.6	Very high	95.1	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-61.5	-48.7	172.5	-69.9	81.2	0	0	0	110.5	Q226 T227 S233 A234 L253 C259 P261 V264	Q226-H230 HydrophobicContact CB-CB 4.12Å; Q226-H230 HydrophobicContact CG-CB 4.43Å; T227-H230 PolarHBondContact N-ND1 3.26Å; T227-H230 VanDerWaalsContact N-ND1 3.14Å; T227-H230 WeakPolarHBondContact O-CB 3.38Å; T227-H230 PolarHBondContact O-N 3.21Å; T227-H230 PolarHBondContact OG1-ND1 3.34Å; H230-S233 PolarHBondContact O-N 2.87Å; H230-A234 WeakPolarHBondContact O-CB 3.44Å; H230-A234 PolarHBondContact O-N 3.38Å; H230-L253 PolarHBondContact CE1-O 3.34Å; H230-L253 VanDerWaalsContact CE1-O 3.23Å; H230-L253 PolarHBondContact NE2-O 3.03Å; H230-C259 PolarHBondContact NE2-O 3.14Å; H230-P261 WeakPolarHBondContact NE2-CD 3.49Å; H230-V264 HydrophobicContact CB-CG2 4.47Å
231	Y	95.4	Very high	95.1	Very high	10 Å²	10	26.7 Å²	26.7	4%	0.039	14%	0.135	C	C	.	.	H	α-helix	trans	-59.3	-51.4	178	-75.5	-94.5	0	0	0	112.1	F90 R193 H197 D201 D222 Q226 T227 A228 S233 A234 C235	F90-Y231 HydrophobicContact CB-CD1 3.9Å; F90-Y231 HydrophobicContact CB-CE1 4.31Å; F90-Y231 AromaticContact CD1-CD1 3.71Å; F90-Y231 HydrophobicContact CD1-CD1 3.71Å; F90-Y231 AromaticContact CD1-CE1 3.46Å; F90-Y231 HydrophobicContact CD1-CE1 3.46Å; F90-Y231 VanDerWaalsContact CD1-CE1 3.46Å; F90-Y231 HydrophobicContact CE1-CD1 4.39Å; F90-Y231 HydrophobicContact CE1-CE1 4.02Å; F90-Y231 AromaticContact CG-CD1 3.92Å; F90-Y231 HydrophobicContact CG-CD1 3.92Å; F90-Y231 HydrophobicContact CG-CE1 4.14Å; R193-Y231 WeakPolarHBondContact CD-OH 3.47Å; H197-Y231 HydrophobicContact CB-CD2 4.25Å; H197-Y231 HydrophobicContact CB-CE2 4.19Å; H197-Y231 AromaticContact CD2-CD2 3.68Å; H197-Y231 AromaticContact CD2-CE2 3.57Å; D201-Y231 HydrophobicContact CB-CD1 3.82Å; D201-Y231 HydrophobicContact CB-CG 4.5Å; D222-Y231 WeakPolarHBondContact OD2-CE2 3.5Å; D222-Y231 PolarHBondContact OD2-OH 2.91Å; Q226-Y231 HydrophobicContact CB-CD2 4.31Å; Q226-Y231 HydrophobicContact CB-CE2 3.72Å; T227-Y231 WeakPolarHBondContact O-CD2 3.09Å; T227-Y231 PolarHBondContact O-N 3.45Å; A228-Y231 PolarHBondContact O-N 2.86Å; Y231-S233 PolarHBondContact O-N 3.35Å; Y231-A234 PolarHBondContact O-N 3.4Å; Y231-C235 WeakPolarHBondContact O-CB 3.28Å; Y231-C235 PolarHBondContact O-N 2.79Å
232	A	95.8	Very high	95.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.4	-35.7	178.5	0	0	0	0	0	112.5	C200 A228 E236 F237 I240 V241 L244	C200-A232 HydrophobicContact CB-CB 4.15Å; A228-A232 PolarHBondContact O-N 3.44Å; A232-E236 PolarHBondContact O-N 3.48Å; A232-E236 VanDerWaalsContact O-N 3.14Å; A232-F237 PolarHBondContact O-N 3.02Å; A232-I240 HydrophobicContact CB-CB 4.33Å; A232-I240 HydrophobicContact CB-CG2 3.8Å; A232-V241 HydrophobicContact CB-CG2 3.79Å; A232-L244 HydrophobicContact CB-CD1 3.96Å
233	S	94.4	Very high	95.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-73.5	-45.5	-179.3	-58.7	0	0	0	0	111.9	L229 H230 Y231 C235 E236 P261 T265 L274	L229-S233 VanDerWaalsContact O-CB 3.24Å; L229-S233 WeakPolarHBondContact O-CB 3.37Å; L229-S233 PolarHBondContact O-N 3.45Å; L229-S233 PolarHBondContact O-OG 3.1Å; H230-S233 PolarHBondContact O-N 2.87Å; Y231-S233 PolarHBondContact O-N 3.35Å; S233-C235 VanDerWaalsContact C-N 3.33Å; S233-C235 PolarHBondContact O-N 2.95Å; S233-E236 WeakPolarHBondContact O-CA 3.32Å; S233-E236 PolarHBondContact O-N 3.15Å; S233-P261 WeakPolarHBondContact CB-O 3.35Å; S233-T265 WeakPolarHBondContact O-CB 3.29Å; S233-T265 PolarHBondContact O-OG1 3.45Å; S233-L274 WeakPolarHBondContact OG-CD1 3.46Å
234	A	90	Very high	95.6	Very high	2 Å²	2	23.1 Å²	23.1	2%	0.017	12%	0.116	C	C	.	.	H	α-helix	trans	-67.3	-31.4	179.1	0	0	0	0	0	113.7	F90 K93 H230 Y231 E236 V264	F90-A234 HydrophobicContact CD2-CB 3.37Å; F90-A234 HydrophobicContact CE2-CB 3.3Å; K93-A234 PolarHBondContact NZ-O 3.47Å; K93-A234 VanDerWaalsContact NZ-O 3.11Å; H230-A234 WeakPolarHBondContact O-CB 3.44Å; H230-A234 PolarHBondContact O-N 3.38Å; Y231-A234 PolarHBondContact O-N 3.4Å; A234-E236 VanDerWaalsContact C-N 3.31Å; A234-V264 WeakPolarHBondContact CA-O 3.44Å; A234-V264 HydrophobicContact CB-CB 4.28Å; A234-V264 HydrophobicContact CB-CG2 3.99Å
235	C	87.2	Confident	96	Very high	21 Å²	21	20.7 Å²	20.7	14%	0.142	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5	170.8	-66.8	0	0	0	0	113.7	F90 Y231 S233 F237	F90-C235 PolarHBondContact N-SG 3.26Å; Y231-C235 WeakPolarHBondContact O-CB 3.28Å; Y231-C235 PolarHBondContact O-N 2.79Å; S233-C235 VanDerWaalsContact C-N 3.33Å; S233-C235 PolarHBondContact O-N 2.95Å; C235-F237 VanDerWaalsContact C-N 3.28Å; C235-F237 HydrophobicContact CB-CD2 3.55Å; C235-F237 HydrophobicContact CB-CE2 3.38Å; C235-F237 HydrophobicContact CB-CG 4.31Å; C235-F237 HydrophobicContact CB-CZ 4.02Å; C235-F237 PolarHBondContact O-N 3.38Å
236	E	92.4	Very high	96.1	Very high	86 Å²	86	27.4 Å²	27.4	40%	0.402	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	27.2	175.9	-51.1	-178.9	166.6	0	0	114.5	A232 S233 A234 L238 G266 C267	A232-E236 PolarHBondContact O-N 3.48Å; A232-E236 VanDerWaalsContact O-N 3.14Å; S233-E236 WeakPolarHBondContact O-CA 3.32Å; S233-E236 PolarHBondContact O-N 3.15Å; A234-E236 VanDerWaalsContact C-N 3.31Å; E236-L238 VanDerWaalsContact C-N 3.3Å; E236-L238 PolarHBondContact O-N 3.4Å; E236-G266 PolarHBondContact OE1-N 3.32Å; E236-C267 HydrophobicContact CB-CB 4.11Å; E236-C267 HydrophobicContact CG-CB 3.78Å; E236-C267 PolarHBondContact OE1-N 2.87Å
237	F	94	Very high	96.2	Very high	50 Å²	50	29.7 Å²	29.7	22%	0.219	15%	0.151	C	C	.	.			trans	-79.2	77.6	174.9	-60.6	-47.2	0	0	0	111.1	C200 D201 A232 C235 D239 I240 V241	C200-F237 VanDerWaalsContact O-CD2 3.23Å; C200-F237 WeakPolarHBondContact O-CD2 3.29Å; C200-F237 WeakPolarHBondContact O-CE2 3.4Å; D201-F237 WeakPolarHBondContact O-CE2 3.48Å; A232-F237 PolarHBondContact O-N 3.02Å; C235-F237 VanDerWaalsContact C-N 3.28Å; C235-F237 HydrophobicContact CB-CD2 3.55Å; C235-F237 HydrophobicContact CB-CE2 3.38Å; C235-F237 HydrophobicContact CB-CG 4.31Å; C235-F237 HydrophobicContact CB-CZ 4.02Å; C235-F237 PolarHBondContact O-N 3.38Å; F237-D239 PolarHBondContact O-N 3.35Å; F237-D239 VanDerWaalsContact O-N 3.15Å; F237-I240 HydrophobicContact CB-CB 4.03Å; F237-I240 HydrophobicContact CB-CD1 4.01Å; F237-I240 HydrophobicContact CB-CG1 4.16Å; F237-I240 HydrophobicContact CD2-CD1 4.3Å; F237-I240 HydrophobicContact CG-CD1 4.31Å; F237-I240 PolarHBondContact O-N 2.91Å; F237-V241 WeakPolarHBondContact O-CG2 3.4Å; F237-V241 PolarHBondContact O-N 3.48Å
238	L	95.8	Very high	96.1	Very high	55 Å²	55	31.5 Å²	31.5	29%	0.288	17%	0.17	S	C	.	.	H	α-helix	trans	-49.7	-42.2	-175.5	177.2	62.3	0	0	0	113.4	E236 V241 E242 T269 V270 V273	E236-L238 VanDerWaalsContact C-N 3.3Å; E236-L238 PolarHBondContact O-N 3.4Å; L238-V241 WeakPolarHBondContact O-CB 3.32Å; L238-V241 PolarHBondContact O-N 3.08Å; L238-E242 HydrophobicContact CD1-CG 4.43Å; L238-E242 WeakPolarHBondContact O-CG 3.18Å; L238-E242 PolarHBondContact O-N 3.03Å; L238-T269 HydrophobicContact CD1-CG2 4.16Å; L238-T269 HydrophobicContact CD2-CG2 3.74Å; L238-V270 HydrophobicContact CB-CG2 4.17Å; L238-V270 HydrophobicContact CD1-CG2 4.05Å; L238-V273 HydrophobicContact CD1-CG2 3.98Å
239	D	97.6	Very high	96	Very high	69 Å²	69	31.5 Å²	31.5	37%	0.369	17%	0.17	S	C	.	.	H	α-helix	trans	-75.7	-24.8	-175.8	69.5	-33.9	0	0	0	113.4	K205 F237 L243	K205-D239 HydrophobicContact CD-CB 4.47Å; K205-D239 WeakPolarHBondContact CD-OD2 3.16Å; K205-D239 IonicContact NZ-OD2 3.76Å; K205-D239 PolarHBondContact NZ-OD2 3.42Å; F237-D239 PolarHBondContact O-N 3.35Å; F237-D239 VanDerWaalsContact O-N 3.15Å; D239-L243 WeakPolarHBondContact O-CB 3.39Å; D239-L243 PolarHBondContact O-N 2.95Å
240	I	98.4	Very high	96	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-76.7	-40.2	168	-62.7	-179.8	0	0	0	110.4	C200 G203 K205 V208 A232 F237 E242 L243 L244	C200-I240 HydrophobicContact CB-CG2 4.4Å; G203-I240 VanDerWaalsContact C-CD1 3.45Å; G203-I240 VanDerWaalsContact CA-CD1 3.49Å; K205-I240 HydrophobicContact CB-CD1 4.2Å; K205-I240 HydrophobicContact CB-CG1 3.89Å; K205-I240 HydrophobicContact CG-CG1 4.25Å; V208-I240 HydrophobicContact CG1-CG2 4.45Å; V208-I240 HydrophobicContact CG2-CG2 4.16Å; A232-I240 HydrophobicContact CB-CB 4.33Å; A232-I240 HydrophobicContact CB-CG2 3.8Å; F237-I240 HydrophobicContact CB-CB 4.03Å; F237-I240 HydrophobicContact CB-CD1 4.01Å; F237-I240 HydrophobicContact CB-CG1 4.16Å; F237-I240 HydrophobicContact CD2-CD1 4.3Å; F237-I240 HydrophobicContact CG-CD1 4.31Å; F237-I240 PolarHBondContact O-N 2.91Å; I240-E242 VanDerWaalsContact C-N 3.34Å; I240-E242 PolarHBondContact O-N 3.45Å; I240-L243 WeakPolarHBondContact O-CB 3.26Å; I240-L243 PolarHBondContact O-N 3.21Å; I240-L244 HydrophobicContact CG2-CD1 4.1Å; I240-L244 HydrophobicContact CG2-CG 4.26Å; I240-L244 WeakPolarHBondContact O-CB 3.49Å; I240-L244 VanDerWaalsContact O-CG 3.32Å; I240-L244 WeakPolarHBondContact O-CG 3.48Å; I240-L244 PolarHBondContact O-N 3.49Å
241	V	98.4	Very high	96	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-56.9	-49.1	173.9	168.5	0	0	0	0	110.4	L229 A232 F237 L238 L243 L244 L245 V270 V273 L274	L229-V241 HydrophobicContact CD1-CB 4.45Å; L229-V241 HydrophobicContact CD1-CG1 4.09Å; L229-V241 HydrophobicContact CD1-CG2 4.41Å; A232-V241 HydrophobicContact CB-CG2 3.79Å; F237-V241 WeakPolarHBondContact O-CG2 3.4Å; F237-V241 PolarHBondContact O-N 3.48Å; L238-V241 WeakPolarHBondContact O-CB 3.32Å; L238-V241 PolarHBondContact O-N 3.08Å; V241-L243 PolarHBondContact O-N 3.25Å; V241-L244 PolarHBondContact O-N 2.64Å; V241-L245 HydrophobicContact CG1-CD1 3.88Å; V241-L245 WeakPolarHBondContact O-CB 3.5Å; V241-L245 VanDerWaalsContact O-CG 3.29Å; V241-L245 WeakPolarHBondContact O-CG 3.44Å; V241-L245 PolarHBondContact O-N 2.79Å; V241-V270 HydrophobicContact CG1-CG1 4.38Å; V241-V270 HydrophobicContact CG2-CG1 4.09Å; V241-V273 HydrophobicContact CG1-CG1 4.31Å; V241-L274 HydrophobicContact CG1-CD2 4.01Å; V241-L274 HydrophobicContact CG1-CG 4.19Å
242	E	98	Very high	96	Very high	80 Å²	80	36 Å²	36	37%	0.374	20%	0.198	S	C	.	.	H	α-helix	trans	-60.3	-44.5	176.1	-74	-179.9	171.6	0	0	112.1	L238 I240 L244 L245 Q246 V273	L238-E242 HydrophobicContact CD1-CG 4.43Å; L238-E242 WeakPolarHBondContact O-CG 3.18Å; L238-E242 PolarHBondContact O-N 3.03Å; I240-E242 VanDerWaalsContact C-N 3.34Å; I240-E242 PolarHBondContact O-N 3.45Å; E242-L244 PolarHBondContact O-N 2.75Å; E242-L245 PolarHBondContact O-N 3.29Å; E242-Q246 WeakPolarHBondContact O-CB 3.19Å; E242-Q246 WeakPolarHBondContact O-CG 3.37Å; E242-Q246 PolarHBondContact O-N 3.49Å; E242-V273 HydrophobicContact CG-CG1 4.21Å
243	L	98.5	Very high	96.1	Very high	29 Å²	29	38.2 Å²	38.2	15%	0.152	21%	0.209	C	C	.	.	H	α-helix	trans	-58.8	-46.8	177.3	173.5	63.2	0	0	0	112	K205 V208 T209 D239 I240 V241 Q246 S247	K205-L243 HydrophobicContact CG-CD2 4.05Å; V208-L243 HydrophobicContact CB-CD2 4.18Å; V208-L243 HydrophobicContact CG1-CD2 3.68Å; V208-L243 HydrophobicContact CG1-CG 4.43Å; T209-L243 WeakPolarHBondContact OG1-CD2 3.5Å; D239-L243 WeakPolarHBondContact O-CB 3.39Å; D239-L243 PolarHBondContact O-N 2.95Å; I240-L243 WeakPolarHBondContact O-CB 3.26Å; I240-L243 PolarHBondContact O-N 3.21Å; V241-L243 PolarHBondContact O-N 3.25Å; L243-Q246 PolarHBondContact O-N 3.32Å; L243-S247 VanDerWaalsContact O-CB 3.28Å; L243-S247 WeakPolarHBondContact O-CB 3.41Å; L243-S247 PolarHBondContact O-N 2.99Å; L243-S247 PolarHBondContact O-OG 2.95Å
244	L	98.6	Very high	96.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.3	-46.5	179.2	-72.1	173.7	0	0	0	111.2	V208 L212 I218 A228 L229 A232 I240 V241 E242 Q246 S247 G248 A249	V208-L244 HydrophobicContact CG1-CD2 4.08Å; L212-L244 HydrophobicContact CD1-CD2 4.33Å; I218-L244 HydrophobicContact CD1-CD2 4.08Å; I218-L244 VanDerWaalsContact CD1-O 3.31Å; I218-L244 WeakPolarHBondContact CD1-O 3.44Å; I218-L244 HydrophobicContact CG1-CD2 4.01Å; A228-L244 HydrophobicContact CB-CD1 4.48Å; L229-L244 HydrophobicContact CB-CD1 4.24Å; L229-L244 HydrophobicContact CD1-CB 4.04Å; L229-L244 HydrophobicContact CD1-CD1 3.94Å; A232-L244 HydrophobicContact CB-CD1 3.96Å; I240-L244 HydrophobicContact CG2-CD1 4.1Å; I240-L244 HydrophobicContact CG2-CG 4.26Å; I240-L244 WeakPolarHBondContact O-CB 3.49Å; I240-L244 VanDerWaalsContact O-CG 3.32Å; I240-L244 WeakPolarHBondContact O-CG 3.48Å; I240-L244 PolarHBondContact O-N 3.49Å; V241-L244 PolarHBondContact O-N 2.64Å; E242-L244 PolarHBondContact O-N 2.75Å; L244-Q246 PolarHBondContact O-N 3.31Å; L244-S247 CarbonylContact O-C 3.21Å; L244-S247 WeakPolarHBondContact O-CA 3.26Å; L244-S247 PolarHBondContact O-N 3.32Å; L244-S247 VanDerWaalsContact O-N 3.08Å; L244-G248 PolarHBondContact O-N 3.48Å; L244-A249 HydrophobicContact CB-CB 3.95Å; L244-A249 VanDerWaalsContact O-CB 3.24Å; L244-A249 WeakPolarHBondContact O-CB 3.09Å; L244-A249 PolarHBondContact O-N 2.9Å
245	L	98	Very high	96.3	Very high	11 Å²	11	45 Å²	45	6%	0.058	24%	0.235	C	C	.	.	H	α-helix	trans	-62.1	-43.2	178.4	-70.9	170.5	0	0	0	112.2	L229 V241 E242 S247 G248 P251 V273 L274 H277	L229-L245 HydrophobicContact CD1-CG 4.36Å; L229-L245 HydrophobicContact CD2-CD2 3.9Å; V241-L245 HydrophobicContact CG1-CD1 3.88Å; V241-L245 WeakPolarHBondContact O-CB 3.5Å; V241-L245 VanDerWaalsContact O-CG 3.29Å; V241-L245 WeakPolarHBondContact O-CG 3.44Å; V241-L245 PolarHBondContact O-N 2.79Å; E242-L245 PolarHBondContact O-N 3.29Å; L245-S247 PolarHBondContact O-N 3.37Å; L245-G248 PolarHBondContact O-N 3.44Å; L245-G248 VanDerWaalsContact O-N 3.17Å; L245-P251 HydrophobicContact CD2-CB 4.09Å; L245-P251 HydrophobicContact CD2-CG 4.16Å; L245-V273 HydrophobicContact CD1-CG1 3.6Å; L245-L274 HydrophobicContact CD1-CD2 4.14Å; L245-L274 HydrophobicContact CD2-CD2 4.31Å; L245-H277 HydrophobicContact CD1-CB 4.31Å; L245-H277 HydrophobicContact CD2-CB 3.92Å
246	Q	96.9	Very high	96.5	Very high	149 Å²	149	50.6 Å²	50.6	70%	0.696	26%	0.26	S	S	*	.	H	α-helix	trans	-63.6	-29.7	174.6	-71.9	169.9	12.7	0	0	112.3	E242 L243 L244 G248	E242-Q246 WeakPolarHBondContact O-CB 3.19Å; E242-Q246 WeakPolarHBondContact O-CG 3.37Å; E242-Q246 PolarHBondContact O-N 3.49Å; L243-Q246 PolarHBondContact O-N 3.32Å; L244-Q246 PolarHBondContact O-N 3.31Å; Q246-G248 VanDerWaalsContact C-N 3.29Å
247	S	97.3	Very high	96.3	Very high	58 Å²	58	53.4 Å²	53.4	41%	0.406	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	2.7	178.3	-56.5	0	0	0	0	113.6	L243 L244 L245	L243-S247 VanDerWaalsContact O-CB 3.28Å; L243-S247 WeakPolarHBondContact O-CB 3.41Å; L243-S247 PolarHBondContact O-N 2.99Å; L243-S247 PolarHBondContact O-OG 2.95Å; L244-S247 CarbonylContact O-C 3.21Å; L244-S247 WeakPolarHBondContact O-CA 3.26Å; L244-S247 PolarHBondContact O-N 3.32Å; L244-S247 VanDerWaalsContact O-N 3.08Å; L245-S247 PolarHBondContact O-N 3.37Å
248	G	96.2	Very high	96.3	Very high	38 Å²	38	52.3 Å²	52.3	39%	0.392	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.2	16.8	173.5	0	0	0	0	0	115.5	L244 L245 Q246	L244-G248 PolarHBondContact O-N 3.48Å; L245-G248 PolarHBondContact O-N 3.44Å; L245-G248 VanDerWaalsContact O-N 3.17Å; Q246-G248 VanDerWaalsContact C-N 3.29Å
249	A	98	Very high	96.2	Very high	2 Å²	2	51.7 Å²	51.7	2%	0.017	28%	0.28	C	S	.	.			trans	-56.8	142.5	171.1	0	0	0	0	0	110.6	I218 N219 L229 L244 P251	I218-A249 HydrophobicContact CD1-CB 3.87Å; I218-A249 HydrophobicContact CG1-CB 3.91Å; N219-A249 WeakPolarHBondContact OD1-CA 3.47Å; L229-A249 HydrophobicContact CD2-CB 4.07Å; L244-A249 HydrophobicContact CB-CB 3.95Å; L244-A249 VanDerWaalsContact O-CB 3.24Å; L244-A249 WeakPolarHBondContact O-CB 3.09Å; L244-A249 PolarHBondContact O-N 2.9Å; A249-P251 VanDerWaalsContact O-CD 3.31Å; A249-P251 WeakPolarHBondContact O-CD 3.45Å
250	D	97.4	Very high	96.1	Very high	41 Å²	41	49.2 Å²	49.2	22%	0.219	27%	0.267	C	S	.	.			trans	-94.8	106.7	177.3	-170.4	-8.5	0	0	0	110.4	N219 T252 L253	N219-D250 PolarHBondContact OD1-N 3.14Å; D250-T252 VanDerWaalsContact CG-OG1 3.29Å; D250-T252 PolarHBondContact O-N 3.24Å; D250-T252 WeakPolarHBondContact OD1-CB 3.42Å; D250-T252 PolarHBondContact OD1-N 3.37Å; D250-T252 PolarHBondContact OD1-OG1 2.89Å; D250-T252 PolarHBondContact OD2-OG1 3Å; D250-L253 HydrophobicContact CB-CD1 3.96Å; D250-L253 HydrophobicContact CB-CG 3.94Å
251	P	97	Very high	96	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.019	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-1	178.5	33.7	-36.8	0	0	0	113.2	L229 L245 A249 P261 L274 H277	L229-P251 HydrophobicContact CD2-CB 4.03Å; L245-P251 HydrophobicContact CD2-CB 4.09Å; L245-P251 HydrophobicContact CD2-CG 4.16Å; A249-P251 VanDerWaalsContact O-CD 3.31Å; A249-P251 WeakPolarHBondContact O-CD 3.45Å; P251-P261 WeakPolarHBondContact O-CD 3.4Å; P251-L274 HydrophobicContact CB-CD2 4.25Å; P251-H277 HydrophobicContact CG-CB 4.18Å
252	T	96.4	Very high	95.8	Very high	63 Å²	63	51 Å²	51	39%	0.387	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-7.6	-178.4	73.2	0	0	0	0	113.8	D250 L260 T278	D250-T252 VanDerWaalsContact CG-OG1 3.29Å; D250-T252 PolarHBondContact O-N 3.24Å; D250-T252 WeakPolarHBondContact OD1-CB 3.42Å; D250-T252 PolarHBondContact OD1-N 3.37Å; D250-T252 PolarHBondContact OD1-OG1 2.89Å; D250-T252 PolarHBondContact OD2-OG1 3Å; T252-L260 WeakPolarHBondContact O-CD2 3.34Å; T252-T278 HydrophobicContact CG2-CG2 4.05Å
253	L	96.9	Very high	95.6	Very high	45 Å²	45	52.3 Å²	52.3	24%	0.236	28%	0.281	C	S	.	.			trans	-67.6	133.2	175.4	-66.8	174.9	0	0	0	109.9	N219 T227 H230 D250 P261	N219-L253 HydrophobicContact CB-CD1 3.76Å; T227-L253 HydrophobicContact CG2-CB 4.14Å; T227-L253 HydrophobicContact CG2-CD1 3.81Å; H230-L253 PolarHBondContact CE1-O 3.34Å; H230-L253 VanDerWaalsContact CE1-O 3.23Å; H230-L253 PolarHBondContact NE2-O 3.03Å; D250-L253 HydrophobicContact CB-CD1 3.96Å; D250-L253 HydrophobicContact CB-CG 3.94Å; L253-P261 WeakPolarHBondContact O-CD 3.35Å
254	R	96.1	Very high	95.1	Very high	131 Å²	131	52.5 Å²	52.5	49%	0.494	28%	0.284	S	S	.	.			trans	-103	143	179.5	-66.6	-179.8	-178.2	-82.2	-5.7	110.6	Q221 G258 C259 L260 E263	Q221-R254 PolarHBondContact NE2-O 2.93Å; R254-G258 WeakPolarHBondContact CD-O 3.5Å; R254-G258 PolarHBondContact NH1-O 3.43Å; R254-C259 VanDerWaalsContact CA-O 3.27Å; R254-C259 WeakPolarHBondContact CA-O 3.21Å; R254-L260 HydrophobicContact CG-CD2 3.72Å; R254-L260 HydrophobicContact CG-CG 4.3Å; R254-E263 IonicContact NH1-OE2 3.88Å
255	D	92.6	Very high	94.7	Very high	14 Å²	14	53.3 Å²	53.3	8%	0.075	29%	0.288	C	S	.	.			trans	-72.8	-177.3	167	69.7	16.3	0	0	0	112.1	G225 Q226 D257 G258 C259	G225-D255 WeakPolarHBondContact O-CA 3.28Å; Q226-D255 HydrophobicContact CG-CB 3.79Å; D255-D257 VanDerWaalsContact C-N 3.26Å; D255-D257 PolarHBondContact O-N 3.35Å; D255-D257 WeakPolarHBondContact OD1-CA 3.44Å; D255-D257 PolarHBondContact OD1-N 3.44Å; D255-G258 WeakPolarHBondContact O-CA 3.49Å; D255-G258 PolarHBondContact O-N 3.48Å; D255-G258 PolarHBondContact OD1-N 3.18Å; D255-G258 VanDerWaalsContact OD1-N 3.07Å; D255-C259 PolarHBondContact N-O 3.31Å; D255-C259 WeakPolarHBondContact OD1-CB 3.46Å; D255-C259 PolarHBondContact OD1-N 3.2Å
256	Q	92.1	Very high	94.1	Very high	139 Å²	139	55.9 Å²	55.9	65%	0.65	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-27.7	-179.5	-80.3	179.6	3.5	0	0	114.2	N223 E224 G258	N223-Q256 PolarHBondContact O-NE2 3.06Å; N223-Q256 PolarHBondContact O-OE1 3.48Å; E224-Q256 WeakPolarHBondContact O-CB 3.45Å; E224-Q256 VanDerWaalsContact O-CG 3.31Å; E224-Q256 WeakPolarHBondContact O-CG 3.39Å; E224-Q256 PolarHBondContact O-N 3.25Å; Q256-G258 PolarHBondContact O-N 2.93Å
257	D	89.1	Confident	93.8	Very high	144 Å²	144	50.4 Å²	50.4	77%	0.77	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-2	174.5	-66.5	-40.4	0	0	0	111.8	D255 C259	D255-D257 VanDerWaalsContact C-N 3.26Å; D255-D257 PolarHBondContact O-N 3.35Å; D255-D257 WeakPolarHBondContact OD1-CA 3.44Å; D255-D257 PolarHBondContact OD1-N 3.44Å; D257-C259 VanDerWaalsContact C-N 3.3Å
258	G	93.3	Very high	93.6	Very high	28 Å²	28	56.1 Å²	56.1	29%	0.289	31%	0.313	S	S	.	.			trans	79.7	11.9	-178	0	0	0	0	0	113	R254 D255 Q256	R254-G258 WeakPolarHBondContact CD-O 3.5Å; R254-G258 PolarHBondContact NH1-O 3.43Å; D255-G258 WeakPolarHBondContact O-CA 3.49Å; D255-G258 PolarHBondContact O-N 3.48Å; D255-G258 PolarHBondContact OD1-N 3.18Å; D255-G258 VanDerWaalsContact OD1-N 3.07Å; Q256-G258 PolarHBondContact O-N 2.93Å
259	C	93.4	Very high	93.6	Very high	41 Å²	41	58 Å²	58	28%	0.277	32%	0.317	S	S	.	.			trans	-81.1	144.4	-179.8	-60.9	0	0	0	0	111.2	H230 R254 D255 D257 E263 V264	H230-C259 PolarHBondContact NE2-O 3.14Å; R254-C259 VanDerWaalsContact CA-O 3.27Å; R254-C259 WeakPolarHBondContact CA-O 3.21Å; D255-C259 PolarHBondContact N-O 3.31Å; D255-C259 WeakPolarHBondContact OD1-CB 3.46Å; D255-C259 PolarHBondContact OD1-N 3.2Å; D257-C259 VanDerWaalsContact C-N 3.3Å; C259-E263 WeakPolarHBondContact CA-OE2 3.38Å; C259-E263 HydrophobicContact CB-CB 4.44Å; C259-V264 HydrophobicContact CB-CG1 4.06Å
260	L	96.3	Very high	93.4	Very high	17 Å²	17	57.9 Å²	57.9	9%	0.089	32%	0.316	C	S	.	.			trans	-87.4	161	170.1	-66.4	169.8	0	0	0	111	T252 R254 E262 E263 V264	T252-L260 WeakPolarHBondContact O-CD2 3.34Å; R254-L260 HydrophobicContact CG-CD2 3.72Å; R254-L260 HydrophobicContact CG-CG 4.3Å; L260-E262 HydrophobicContact CB-CG 4.17Å; L260-E262 PolarHBondContact O-N 3.34Å; L260-E262 VanDerWaalsContact O-N 3.08Å; L260-E263 HydrophobicContact CB-CG 4.2Å; L260-E263 PolarHBondContact N-OE2 2.81Å; L260-E263 WeakPolarHBondContact O-CB 3.39Å; L260-E263 PolarHBondContact O-N 3.48Å; L260-V264 PolarHBondContact O-N 2.54Å
261	P	95.2	Very high	93.2	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-30.7	173.3	-26.4	33.8	0	0	0	114.1	L229 H230 S233 P251 L253 E263 V264 L274	L229-P261 HydrophobicContact CB-CG 4.38Å; L229-P261 HydrophobicContact CD2-CB 4.22Å; L229-P261 HydrophobicContact CD2-CG 4.03Å; L229-P261 HydrophobicContact CG-CB 3.93Å; L229-P261 HydrophobicContact CG-CG 4.07Å; H230-P261 WeakPolarHBondContact NE2-CD 3.49Å; S233-P261 WeakPolarHBondContact CB-O 3.35Å; P251-P261 WeakPolarHBondContact O-CD 3.4Å; L253-P261 WeakPolarHBondContact O-CD 3.35Å; P261-E263 VanDerWaalsContact C-N 3.3Å; P261-V264 VanDerWaalsContact O-CG2 3.24Å; P261-V264 WeakPolarHBondContact O-CG2 3.43Å; P261-L274 HydrophobicContact CB-CD1 4.3Å; P261-L274 HydrophobicContact CB-CD2 4.19Å
262	E	95.3	Very high	93.1	Very high	38 Å²	38	61.7 Å²	61.7	18%	0.178	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-20.5	178.3	71.8	177.2	-126.3	0	0	114	L260 T265 L274 Q275	L260-E262 HydrophobicContact CB-CG 4.17Å; L260-E262 PolarHBondContact O-N 3.34Å; L260-E262 VanDerWaalsContact O-N 3.08Å; E262-T265 WeakPolarHBondContact O-CG2 3.48Å; E262-L274 HydrophobicContact CB-CB 3.76Å; E262-L274 HydrophobicContact CB-CD1 3.84Å; E262-L274 HydrophobicContact CB-CG 4.44Å; E262-Q275 VanDerWaalsContact CD-CG 3.49Å; E262-Q275 WeakPolarHBondContact OE1-CG 3.35Å; E262-Q275 PolarHBondContact OE1-NE2 2.93Å; E262-Q275 VanDerWaalsContact OE1-NE2 3.16Å; E262-Q275 WeakPolarHBondContact OE2-CG 3.48Å
263	E	92.1	Very high	93.1	Very high	107 Å²	107	59.9 Å²	59.9	50%	0.5	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-19	-176.8	-63.6	173.5	146.6	0	0	111.5	R254 C259 L260 P261	R254-E263 IonicContact NH1-OE2 3.88Å; C259-E263 WeakPolarHBondContact CA-OE2 3.38Å; C259-E263 HydrophobicContact CB-CB 4.44Å; L260-E263 HydrophobicContact CB-CG 4.2Å; L260-E263 PolarHBondContact N-OE2 2.81Å; L260-E263 WeakPolarHBondContact O-CB 3.39Å; L260-E263 PolarHBondContact O-N 3.48Å; P261-E263 VanDerWaalsContact C-N 3.3Å
264	V	89	Confident	93	Very high	34 Å²	34	57.7 Å²	57.7	21%	0.206	32%	0.315	C	S	.	.	S	Bend	trans	-88.8	-1.7	178.8	-57.1	0	0	0	0	114.1	H230 A234 C259 L260 P261	H230-V264 HydrophobicContact CB-CG2 4.47Å; A234-V264 WeakPolarHBondContact CA-O 3.44Å; A234-V264 HydrophobicContact CB-CB 4.28Å; A234-V264 HydrophobicContact CB-CG2 3.99Å; C259-V264 HydrophobicContact CB-CG1 4.06Å; L260-V264 PolarHBondContact O-N 2.54Å; P261-V264 VanDerWaalsContact O-CG2 3.24Å; P261-V264 WeakPolarHBondContact O-CG2 3.43Å
265	T	89.4	Confident	92.8	Very high	16 Å²	16	55.5 Å²	55.5	10%	0.098	31%	0.31	C	S	.	.			trans	-108.3	143.9	-178.9	-169.8	0	0	0	0	112.7	S233 E262 C267 V270 S271	S233-T265 WeakPolarHBondContact O-CB 3.29Å; S233-T265 PolarHBondContact O-OG1 3.45Å; E262-T265 WeakPolarHBondContact O-CG2 3.48Å; T265-C267 PolarHBondContact OG1-N 2.97Å; T265-V270 HydrophobicContact CG2-CB 4.21Å; T265-V270 HydrophobicContact CG2-CG1 3.94Å; T265-S271 VanDerWaalsContact CG2-OG 3.28Å; T265-S271 WeakPolarHBondContact CG2-OG 3.5Å
266	G	86.7	Confident	92.7	Very high	66 Å²	66	64.1 Å²	64.1	68%	0.68	34%	0.342	S	S	*	.			trans	-90.8	-10.7	170.4	0	0	0	0	0	113.3	E236 K268	E236-G266 PolarHBondContact OE1-N 3.32Å; G266-K268 PolarHBondContact O-N 3.24Å
267	C	89.7	Confident	92.5	Very high	34 Å²	34	61.4 Å²	61.4	23%	0.23	33%	0.329	C	S	.	.			trans	-85.8	112.6	-173.9	179.9	0	0	0	0	111.6	E236 T265 T269 V270 S271	E236-C267 HydrophobicContact CB-CB 4.11Å; E236-C267 HydrophobicContact CG-CB 3.78Å; E236-C267 PolarHBondContact OE1-N 2.87Å; T265-C267 PolarHBondContact OG1-N 2.97Å; C267-T269 PolarHBondContact O-N 3.49Å; C267-T269 VanDerWaalsContact O-N 3.15Å; C267-V270 HydrophobicContact CB-CB 4.11Å; C267-V270 HydrophobicContact CB-CG2 3.98Å; C267-V270 PolarHBondContact O-N 3.11Å; C267-V270 VanDerWaalsContact O-N 3.08Å; C267-S271 PolarHBondContact O-N 2.83Å; C267-S271 PolarHBondContact O-OG 3.1Å
268	K	93.6	Very high	92	Very high	177 Å²	177	56.3 Å²	56.3	77%	0.77	30%	0.303	S	S	*	.	H	α-helix	trans	-53.5	-37.8	178.2	-66.1	-177.3	-179.8	179.4	0	113.4	G266 L272	G266-K268 PolarHBondContact O-N 3.24Å; K268-L272 WeakPolarHBondContact O-CB 3.31Å; K268-L272 VanDerWaalsContact O-CG 3.26Å; K268-L272 WeakPolarHBondContact O-CG 3.36Å; K268-L272 PolarHBondContact O-N 3.46Å
269	T	95.1	Very high	90.8	Very high	77 Å²	77	60.1 Å²	60.1	47%	0.472	32%	0.321	S	S	.	.	H	α-helix	trans	-66.3	-44.6	-179.8	-53	0	0	0	0	111.1	L238 C267 L272 V273	L238-T269 HydrophobicContact CD1-CG2 4.16Å; L238-T269 HydrophobicContact CD2-CG2 3.74Å; C267-T269 PolarHBondContact O-N 3.49Å; C267-T269 VanDerWaalsContact O-N 3.15Å; T269-L272 PolarHBondContact O-N 2.97Å; T269-V273 WeakPolarHBondContact O-CG2 3.31Å; T269-V273 PolarHBondContact O-N 3.49Å; T269-V273 VanDerWaalsContact O-N 3.08Å
270	V	94.1	Very high	89.1	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.1	-47.1	177.8	174.8	0	0	0	0	110.3	L238 V241 T265 C267 L272 V273 L274	L238-V270 HydrophobicContact CB-CG2 4.17Å; L238-V270 HydrophobicContact CD1-CG2 4.05Å; V241-V270 HydrophobicContact CG1-CG1 4.38Å; V241-V270 HydrophobicContact CG2-CG1 4.09Å; T265-V270 HydrophobicContact CG2-CB 4.21Å; T265-V270 HydrophobicContact CG2-CG1 3.94Å; C267-V270 HydrophobicContact CB-CB 4.11Å; C267-V270 HydrophobicContact CB-CG2 3.98Å; C267-V270 PolarHBondContact O-N 3.11Å; C267-V270 VanDerWaalsContact O-N 3.08Å; V270-L272 VanDerWaalsContact C-N 3.32Å; V270-L272 PolarHBondContact O-N 3.26Å; V270-V273 PolarHBondContact O-N 2.76Å; V270-L274 HydrophobicContact CG1-CD1 3.78Å; V270-L274 WeakPolarHBondContact O-CG 3.32Å; V270-L274 PolarHBondContact O-N 2.94Å
271	S	94.9	Very high	87	Confident	22 Å²	22	66.8 Å²	66.8	15%	0.154	36%	0.363	C	S	.	.	H	α-helix	trans	-56.2	-44.4	175.6	-52.3	0	0	0	0	112.2	T265 C267 V273 L274 Q275	T265-S271 VanDerWaalsContact CG2-OG 3.28Å; T265-S271 WeakPolarHBondContact CG2-OG 3.5Å; C267-S271 PolarHBondContact O-N 2.83Å; C267-S271 PolarHBondContact O-OG 3.1Å; S271-V273 PolarHBondContact O-N 3.22Å; S271-L274 PolarHBondContact O-N 3.44Å; S271-Q275 VanDerWaalsContact O-CG 3.31Å; S271-Q275 WeakPolarHBondContact O-CG 3.45Å; S271-Q275 PolarHBondContact O-N 3.39Å
272	L	94.3	Very high	84.4	Confident	103 Å²	103	74.1 Å²	74.1	54%	0.539	42%	0.424	S	S	.	.	H	α-helix	trans	-64.1	-38.7	179	-76.3	172	0	0	0	112.7	K268 T269 V270 R276	K268-L272 WeakPolarHBondContact O-CB 3.31Å; K268-L272 VanDerWaalsContact O-CG 3.26Å; K268-L272 WeakPolarHBondContact O-CG 3.36Å; K268-L272 PolarHBondContact O-N 3.46Å; T269-L272 PolarHBondContact O-N 2.97Å; V270-L272 VanDerWaalsContact C-N 3.32Å; V270-L272 PolarHBondContact O-N 3.26Å; L272-R276 WeakPolarHBondContact O-CD 3.32Å; L272-R276 WeakPolarHBondContact O-CG 3.43Å; L272-R276 PolarHBondContact O-N 3.08Å
273	V	95.5	Very high	83.9	Confident	24 Å²	24	76 Å²	76	15%	0.145	44%	0.436	C	S	.	.	H	α-helix	trans	-63.8	-44.7	176.5	167.5	0	0	0	0	110.4	L238 V241 E242 L245 T269 V270 S271 R276 H277	L238-V273 HydrophobicContact CD1-CG2 3.98Å; V241-V273 HydrophobicContact CG1-CG1 4.31Å; E242-V273 HydrophobicContact CG-CG1 4.21Å; L245-V273 HydrophobicContact CD1-CG1 3.6Å; T269-V273 WeakPolarHBondContact O-CG2 3.31Å; T269-V273 PolarHBondContact O-N 3.49Å; T269-V273 VanDerWaalsContact O-N 3.08Å; V270-V273 PolarHBondContact O-N 2.76Å; S271-V273 PolarHBondContact O-N 3.22Å; V273-R276 PolarHBondContact O-N 3.5Å; V273-H277 PolarHBondContact O-CD2 3.1Å; V273-H277 PolarHBondContact O-N 3.35Å
274	L	94.7	Very high	83.5	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-63.4	-46.6	179	-67.9	160.3	0	0	0	112	L229 S233 V241 L245 P251 P261 E262 V270 S271 R276 H277 T278	L229-L274 HydrophobicContact CD1-CD2 4.04Å; L229-L274 HydrophobicContact CD2-CD2 3.89Å; L229-L274 HydrophobicContact CG-CD2 4.06Å; S233-L274 WeakPolarHBondContact OG-CD1 3.46Å; V241-L274 HydrophobicContact CG1-CD2 4.01Å; V241-L274 HydrophobicContact CG1-CG 4.19Å; L245-L274 HydrophobicContact CD1-CD2 4.14Å; L245-L274 HydrophobicContact CD2-CD2 4.31Å; P251-L274 HydrophobicContact CB-CD2 4.25Å; P261-L274 HydrophobicContact CB-CD1 4.3Å; P261-L274 HydrophobicContact CB-CD2 4.19Å; E262-L274 HydrophobicContact CB-CB 3.76Å; E262-L274 HydrophobicContact CB-CD1 3.84Å; E262-L274 HydrophobicContact CB-CG 4.44Å; V270-L274 HydrophobicContact CG1-CD1 3.78Å; V270-L274 WeakPolarHBondContact O-CG 3.32Å; V270-L274 PolarHBondContact O-N 2.94Å; S271-L274 PolarHBondContact O-N 3.44Å; L274-R276 VanDerWaalsContact C-N 3.27Å; L274-R276 PolarHBondContact O-N 3.4Å; L274-H277 PolarHBondContact O-N 3.34Å; L274-T278 PolarHBondContact O-N 3.08Å; L274-T278 PolarHBondContact O-OG1 3.21Å; L274-T278 VanDerWaalsContact O-OG1 3.13Å
275	Q	92.3	Very high	83.2	Confident	84 Å²	84	76.6 Å²	76.6	39%	0.393	45%	0.446	S	S	.	.	H	α-helix	trans	-57.3	-38.8	178.1	-75.5	176.7	-6.6	0	0	113.2	E262 S271 H277 T278 T279	E262-Q275 VanDerWaalsContact CD-CG 3.49Å; E262-Q275 WeakPolarHBondContact OE1-CG 3.35Å; E262-Q275 PolarHBondContact OE1-NE2 2.93Å; E262-Q275 VanDerWaalsContact OE1-NE2 3.16Å; E262-Q275 WeakPolarHBondContact OE2-CG 3.48Å; S271-Q275 VanDerWaalsContact O-CG 3.31Å; S271-Q275 WeakPolarHBondContact O-CG 3.45Å; S271-Q275 PolarHBondContact O-N 3.39Å; Q275-H277 VanDerWaalsContact C-N 3.28Å; Q275-H277 PolarHBondContact O-N 3.16Å; Q275-T278 PolarHBondContact O-N 3.15Å; Q275-T279 WeakPolarHBondContact O-CG2 3.38Å; Q275-T279 PolarHBondContact O-N 3.02Å; Q275-T279 PolarHBondContact O-OG1 3.21Å
276	R	90.2	Very high	82.8	Confident	195 Å²	195	80.1 Å²	80.1	74%	0.736	47%	0.466	S	S	*	.	H	α-helix	trans	-65.2	-32.9	177.4	-70.9	172.5	76.2	139.1	6.7	112.3	L272 V273 L274 T279	L272-R276 WeakPolarHBondContact O-CD 3.32Å; L272-R276 WeakPolarHBondContact O-CG 3.43Å; L272-R276 PolarHBondContact O-N 3.08Å; V273-R276 PolarHBondContact O-N 3.5Å; L274-R276 VanDerWaalsContact C-N 3.27Å; L274-R276 PolarHBondContact O-N 3.4Å; R276-T279 PolarHBondContact O-OG1 3.23Å
277	H	87.9	Confident	82.5	Confident	83 Å²	83	81 Å²	81	38%	0.384	45%	0.453	S	S	.	.	H	α-helix	trans	-83.6	-25.4	177.9	-80.9	-101.7	0	0	0	113.1	L245 P251 V273 L274 Q275	L245-H277 HydrophobicContact CD1-CB 4.31Å; L245-H277 HydrophobicContact CD2-CB 3.92Å; P251-H277 HydrophobicContact CG-CB 4.18Å; V273-H277 PolarHBondContact O-CD2 3.1Å; V273-H277 PolarHBondContact O-N 3.35Å; L274-H277 PolarHBondContact O-N 3.34Å; Q275-H277 VanDerWaalsContact C-N 3.28Å; Q275-H277 PolarHBondContact O-N 3.16Å
278	T	79.9	Confident	82.1	Confident	37 Å²	37	84.1 Å²	84.1	23%	0.227	47%	0.468	C	S	.	.	H	α-helix	trans	-70.8	-43.5	171.7	-57.2	0	0	0	0	111.8	T252 L274 Q275 G280	T252-T278 HydrophobicContact CG2-CG2 4.05Å; L274-T278 PolarHBondContact O-N 3.08Å; L274-T278 PolarHBondContact O-OG1 3.21Å; L274-T278 VanDerWaalsContact O-OG1 3.13Å; Q275-T278 PolarHBondContact O-N 3.15Å; T278-G280 VanDerWaalsContact C-N 3.35Å; T278-G280 PolarHBondContact O-N 3.03Å
279	T	67.1	Low	81.3	Confident	107 Å²	107	77.5 Å²	77.5	66%	0.656	45%	0.446	S	S	*	.	H	α-helix	trans	-73.9	-20.5	-177.2	48.9	0	0	0	0	114.5	Q275 R276	Q275-T279 WeakPolarHBondContact O-CG2 3.38Å; Q275-T279 PolarHBondContact O-N 3.02Å; Q275-T279 PolarHBondContact O-OG1 3.21Å; R276-T279 PolarHBondContact O-OG1 3.23Å
280	G	58.6	Low	80.2	Confident	67 Å²	67	77.5 Å²	77.5	69%	0.691	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-7.7	177.8	0	0	0	0	0	115.6	T278	T278-G280 VanDerWaalsContact C-N 3.35Å; T278-G280 PolarHBondContact O-N 3.03Å
281	K	52.2	Low	79	Confident	132 Å²	132	84 Å²	84	57%	0.574	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	0.1	-178	-73.2	-173.1	179.7	175.8	0	114.3
282	A	40.7	Very low	77.6	Confident	154 Å²	154	89.6 Å²	89.6	100%	1.273	51%	0.511	S	S	*	.			trans	-88.8	0	179.9	0	0	0	0	0	112.9

Retrieved 282 of 282 residues in 73.8 ms (Link to these results)

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